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Murcko scaffold

Ring system with 3 rings and 14 atoms

23 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
14
Chemicals
23
With full pages
1
Scaffold SMILES

c1nc(NC2CCC2)c2cc[nH]c2n1

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 scaffold
Murcko scaffold c1nc(NC2CCC2)c2cc[nH]c2n1

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 1 to 23 of 23 chemicals

N-Cyclobutyl-2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine chemical structure, C11H14N4, CAS 71149-50-3
N-Cyclobutyl-2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS 71149-50-3C11H14N4
Abrocitinib impurity 57 chemical structure, C11H14N4, CAS 252853-75-1
Abrocitinib impurity 57
CAS 252853-75-1C11H14N4
2-Chloro-N-cyclobutyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine chemical structure, C10H11ClN4, CAS 934600-48-3
2-Chloro-N-cyclobutyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS 934600-48-3C10H11ClN4
5-Bromo-2-chloro-N-cyclobutyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine chemical structure, C10H10BrClN4, CAS 1192711-67-3
5-Bromo-2-chloro-N-cyclobutyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS 1192711-67-3C10H10BrClN4
2,5-Dichloro-N-cyclobutyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine chemical structure, C10H10Cl2N4, CAS 1192711-68-4
2,5-Dichloro-N-cyclobutyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS 1192711-68-4C10H10Cl2N4
N-(cis-3-(Methyl(7H-pyrrolo(2,3-d)pyrimidin-4-yl)amino)cyclobutyl)-1-propanesulfonamide chemical structure, C14H21N5O2S, CAS 1622902-68-4
N-(cis-3-(Methyl(7H-pyrrolo(2,3-d)pyrimidin-4-yl)amino)cyclobutyl)-1-propanesulfonamide
CAS 1622902-68-4C14H21N5O2S
2-Methyl-N-[cis-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)cyclobutyl]-1-propanesulfonamide chemical structure, C15H23N5O2S, CAS 1622902-69-5
2-Methyl-N-[cis-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)cyclobutyl]-1-propanesulfonamide
CAS 1622902-69-5C15H23N5O2S
2-Chloro-N-cyclobutyl-6-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine chemical structure, C11H13ClN4, CAS 1192711-72-0
2-Chloro-N-cyclobutyl-6-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS 1192711-72-0C11H13ClN4
N-Despropylsulfonyl abrocitinib hydrochloride chemical structure, C11H16ClN5, CAS 1622903-13-2
N-Despropylsulfonyl abrocitinib hydrochloride
CAS 1622903-13-2C11H16ClN5
N1-methyl-N1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)cyclobutane-1,3-diamine chemical structure, C11H15N5, CAS 1622980-99-7
N1-methyl-N1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)cyclobutane-1,3-diamine
CAS 1622980-99-7C11H15N5
Abrocitinib impurity 29 chemical structure, C13H19N5O2S, CAS 2204276-97-9
Abrocitinib impurity 29
CAS 2204276-97-9C13H19N5O2S
N-(3,3-Dimethylcyclobutyl)-N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine chemical structure, C13H18N4, CAS 2361736-25-4
N-(3,3-Dimethylcyclobutyl)-N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS 2361736-25-4C13H18N4
(1s,3s)-3-(Methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutanecarboxylic acid chemical structure, C12H14N4O2, CAS 2407868-89-5
(1s,3s)-3-(Methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutanecarboxylic acid
CAS 2407868-89-5C12H14N4O2
(1s,3s)-N-Hydroxy-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutanecarboxamide chemical structure, C12H15N5O2, CAS 2407868-83-9
(1s,3s)-N-Hydroxy-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutanecarboxamide
CAS 2407868-83-9C12H15N5O2
(1s,3s)-3-(Methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutanecarboxamide chemical structure, C12H15N5O, CAS 2407868-88-4
(1s,3s)-3-(Methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutanecarboxamide
CAS 2407868-88-4C12H15N5O
(1s,3s)-Methyl 3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutanecarboxylate chemical structure, C13H16N4O2, CAS 2413372-64-0
(1s,3s)-Methyl 3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutanecarboxylate
CAS 2413372-64-0C13H16N4O2
Abrocitinib metabolite M3 chemical structure, C14H21N5O3S, CAS 2744171-53-5
Abrocitinib metabolite M3
CAS 2744171-53-5C14H21N5O3S
Hydroxy abrocitinib chemical structure, C14H21N5O3S, CAS 2744171-54-6
Hydroxy abrocitinib
CAS 2744171-54-6C14H21N5O3S
Abrocitinib metabolite M2 chemical structure, C14H21N5O3S, CAS 2744171-52-4
Abrocitinib metabolite M2
CAS 2744171-52-4C14H21N5O3S
N-(2-Chloroethyl)-N-cyclobutyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine chemical structure, C12H15ClN4, CAS 2144170-75-0
N-(2-Chloroethyl)-N-cyclobutyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS 2144170-75-0C12H15ClN4
N1-methyl-N1-(2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)cyclobutane-1,3-diamine chemical structure, C12H17N5, CAS 2425353-27-9
N1-methyl-N1-(2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)cyclobutane-1,3-diamine
CAS 2425353-27-9C12H17N5
N4-cyclobutyl-N4-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine chemical structure, C11H15N5, CAS 2299665-69-1
N4-cyclobutyl-N4-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
CAS 2299665-69-1C11H15N5
Abrocitinib desmethyl impurity 7 chemical structure, C13H19N5O2S, CAS 2920890-22-6
Abrocitinib desmethyl impurity 7
CAS 2920890-22-6C13H19N5O2S