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Murcko scaffold

Octahydro-1H-pyrrolo[3,4-b]pyridine scaffold

75 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
9
Chemicals
75
With full pages
7
Scaffold SMILES

C1CNC2CNCC2C1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffoldOpen the Octahydro-1H-pyrrolo[3,4-b]pyridine page
Murcko scaffold C1CNC2CNCC2C1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 49 to 75 of 75 chemicals

tert-Butyl 4-(dimethylamino)octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate chemical structure, C14H27N3O2, CAS 2306270-43-7
tert-Butyl 4-(dimethylamino)octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
CAS 2306270-43-7C14H27N3O2
tert-Butyl (4aS,7aS)-1-[2-cyano-2-(ethoxymethylidene)acetyl]-octahydro-1H-pyrrolo[3,4-b]pyridine-6-carboxylate chemical structure, C18H27N3O4, CAS 2094025-03-1
tert-Butyl (4aS,7aS)-1-[2-cyano-2-(ethoxymethylidene)acetyl]-octahydro-1H-pyrrolo[3,4-b]pyridine-6-carboxylate
CAS 2094025-03-1C18H27N3O4
tert-Butyl (4aS,7aS)-1-(carboxy)-octahydro-1H-pyrrolo[3,4-b]pyridine-6-carboxylate chemical structure, C13H21ClN2O3, CAS 2287247-91-8
tert-Butyl (4aS,7aS)-1-(carboxy)-octahydro-1H-pyrrolo[3,4-b]pyridine-6-carboxylate
CAS 2287247-91-8C13H21ClN2O3
tert-Butyl (4aS,7aS)-1-(chlorosulfonyl)-octahydro-1H-pyrrolo[3,4-b]pyridine-6-carboxylate chemical structure, C12H21ClN2O4S, CAS 2241107-48-0
tert-Butyl (4aS,7aS)-1-(chlorosulfonyl)-octahydro-1H-pyrrolo[3,4-b]pyridine-6-carboxylate
CAS 2241107-48-0C12H21ClN2O4S
Diethyl hexahydro-1H-pyrrolo[3,4-b]pyridine-1,6(2H)-dicarboxylate chemical structure, C13H22N2O4, CAS 1184157-43-4
Diethyl hexahydro-1H-pyrrolo[3,4-b]pyridine-1,6(2H)-dicarboxylate
CAS 1184157-43-4C13H22N2O4
1H-Pyrrolo[3,4-b]pyridine-1,4a(7aH)-dicarboxylic acid, hexahydro-, 1-(1,1-dimethylethyl) 4a-ethyl ester, (4aR,7aS)-rel- chemical structure, C15H26N2O4, CAS 1330766-28-3
1H-Pyrrolo[3,4-b]pyridine-1,4a(7aH)-dicarboxylic acid, hexahydro-, 1-(1,1-dimethylethyl) 4a-ethyl ester, (4aR,7aS)-rel-
CAS 1330766-28-3C15H26N2O4
(4aS,7aS)-Octahydro-1H-pyrrolo[3,4-b]pyridine-1-sulfonyl chloride chemical structure, C7H13ClN2O2S, CAS 2757832-62-3
(4aS,7aS)-Octahydro-1H-pyrrolo[3,4-b]pyridine-1-sulfonyl chloride
CAS 2757832-62-3C7H13ClN2O2S
(4aS,7aS)-Octahydro-1H-pyrrolo[3,4-b]pyridine-1-carbonyl chloride chemical structure, C8H13ClN2O, CAS 2920085-90-9
(4aS,7aS)-Octahydro-1H-pyrrolo[3,4-b]pyridine-1-carbonyl chloride
CAS 2920085-90-9C8H13ClN2O
1-(Methylsulfonyl)octahydro-1H-pyrrolo[3,4-b]pyridine hydrochloride chemical structure, C8H17ClN2O2S, CAS 2748507-64-2
1-(Methylsulfonyl)octahydro-1H-pyrrolo[3,4-b]pyridine hydrochloride
CAS 2748507-64-2C8H17ClN2O2S
1-(Octahydro-1H-pyrrolo[3,4-b]pyridin-1-yl)ethan-1-one hydrochloride chemical structure, C9H17ClN2O, CAS 2749690-43-3
1-(Octahydro-1H-pyrrolo[3,4-b]pyridin-1-yl)ethan-1-one hydrochloride
CAS 2749690-43-3C9H17ClN2O
tert-Butyl 6-(2-chloroacetyl)octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate chemical structure, C14H23ClN2O3, CAS 3078325-57-9
tert-Butyl 6-(2-chloroacetyl)octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
CAS 3078325-57-9C14H23ClN2O3
(4aR,7aR)-Octahydro-1H-pyrrolo[3,4-b]pyridine hydrochloride chemical structure, C7H15ClN2, CAS 724461-04-5
(4aR,7aR)-Octahydro-1H-pyrrolo[3,4-b]pyridine hydrochloride
CAS 724461-04-5C7H15ClN2
(4aS,7aR)-6-tert-Butoxycarbonyl-1-methyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-7a-carboxylic acid chemical structure, C14H24N2O4, CAS 2920233-68-5
(4aS,7aR)-6-tert-Butoxycarbonyl-1-methyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-7a-carboxylic acid
CAS 2920233-68-5C14H24N2O4
1H-Pyrrolo[3,4-b]pyridine, octahydro-, hydrochloride (1:2) chemical structure, C7H15ClN2
1H-Pyrrolo[3,4-b]pyridine, octahydro-, hydrochloride (1:2)
C7H15ClN2
(4aS,7aS)-1-Ethyloctahydro-1H-pyrrolo[3,4-b]pyridine chemical structure, C9H18N2, CAS 1932592-78-3
(4aS,7aS)-1-Ethyloctahydro-1H-pyrrolo[3,4-b]pyridine
CAS 1932592-78-3C9H18N2
[(4aS,7aR)-1,6-Dimethyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridin-7a-yl]methanol chemical structure, C10H20N2O, CAS 2920231-93-0
[(4aS,7aR)-1,6-Dimethyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridin-7a-yl]methanol
CAS 2920231-93-0C10H20N2O
Methyl (4aS,7aR)-1-methyl-3,4,4a,5,6,7-hexahydro-2H-pyrrolo[3,4-b]pyridine-7a-carboxylate chemical structure, C10H18N2O2, CAS 2920207-12-9
Methyl (4aS,7aR)-1-methyl-3,4,4a,5,6,7-hexahydro-2H-pyrrolo[3,4-b]pyridine-7a-carboxylate
CAS 2920207-12-9C10H18N2O2
Methyl (4aR,7aR)-1-methyl-3,4,4a,5,6,7-hexahydro-2H-pyrrolo[3,4-b]pyridine-7a-carboxylate chemical structure, C10H18N2O2, CAS 2940874-46-2
Methyl (4aR,7aR)-1-methyl-3,4,4a,5,6,7-hexahydro-2H-pyrrolo[3,4-b]pyridine-7a-carboxylate
CAS 2940874-46-2C10H18N2O2
tert-Butyl (4aS,7aS)-7a-(aminomethyl)-1-methyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-6-carboxylate chemical structure, C14H27N3O2, CAS 2940867-41-2
tert-Butyl (4aS,7aS)-7a-(aminomethyl)-1-methyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-6-carboxylate
CAS 2940867-41-2C14H27N3O2
tert-Butyl (4aS,7aR)-7a-(hydroxymethyl)-1-methyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-6-carboxylate chemical structure, C14H26N2O3, CAS 2940879-86-5
tert-Butyl (4aS,7aR)-7a-(hydroxymethyl)-1-methyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-6-carboxylate
CAS 2940879-86-5C14H26N2O3
(4aS,7aR)-1-Methyl-6-[(2-methylpropan-2-yl)oxycarbonyl]-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-7a-carboxylic acid chemical structure, C14H24N2O4
(4aS,7aR)-1-Methyl-6-[(2-methylpropan-2-yl)oxycarbonyl]-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-7a-carboxylic acid
C14H24N2O4
O6-tert-butyl O7a-methyl (4aS,7aR)-2,3,4,4a,5,7-hexahydro-1H-pyrrolo[3,4-b]pyridine-6,7a-dicarboxylate chemical structure, C14H24N2O4, CAS 2920207-61-8
O6-tert-butyl O7a-methyl (4aS,7aR)-2,3,4,4a,5,7-hexahydro-1H-pyrrolo[3,4-b]pyridine-6,7a-dicarboxylate
CAS 2920207-61-8C14H24N2O4
O6-tert-butyl O7a-methyl (4aS,7aR)-1-methyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-6,7a-dicarboxylate chemical structure, C15H26N2O4, CAS 2920238-89-5
O6-tert-butyl O7a-methyl (4aS,7aR)-1-methyl-2,3,4,4a,5,7-hexahydropyrrolo[3,4-b]pyridine-6,7a-dicarboxylate
CAS 2920238-89-5C15H26N2O4
tert-Butyl (4aS,7aS)-4,4-difluoro-octahydro-1H-pyrrolo[3,4-b]pyridine-6-carboxylate chemical structure, C12H20F2N2O2, CAS 1251001-72-5
tert-Butyl (4aS,7aS)-4,4-difluoro-octahydro-1H-pyrrolo[3,4-b]pyridine-6-carboxylate
CAS 1251001-72-5C12H20F2N2O2