Murcko scaffold
Ring system with 2 rings and 15 atoms
61 chemicals on CompoundList share this ring system.
- Rings
- 2
- Scaffold atoms
- 15
- Chemicals
- 61
- With full pages
- 3
Scaffold SMILES
O=C(NCc1ccccc1)C1CCCN1
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.
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 48 of 61 chemicals
Doreptide
CAS 90104-48-6C17H24N4O3
![tert-Butyl-(2R)-2-[(benzylamino)carbonyl]pyrrolidine-1-carboxylate chemical structure, C17H24N2O3, CAS 177032-44-9](/s/UXNQYRWHHXUIEQ-CQSZACIVSA-N.svg)
tert-Butyl-(2R)-2-[(benzylamino)carbonyl]pyrrolidine-1-carboxylate
CAS 177032-44-9C17H24N2O3
Pyrrolidine-2-carboxylic acid 3,4-dimethoxy-benzylamide
CAS 438581-56-7C14H20N2O3
Smac peptido-mimetic 1
CAS 642090-91-3C20H30N4O3
L-Prolin-N-(2-(tert-butyloxycarbonylaminomethyl)-5-chlorobenzyl)amide
CAS 439117-44-9C18H26ClN3O3
(2S)-N-Benzylpyrrolidine-2-carboxamide
CAS 116774-46-0C12H16N2O
(2S,4R)-N-Benzyl-4-hydroxypyrrolidine-2-carboxamide
CAS 741663-35-4C12H16N2O2
![2-Pyrrolidinecarboxamide, N-[(1S)-1-phenylethyl]-, (2S)- chemical structure, C13H18N2O, CAS 149673-13-2](/s/KZRJJJOYTGVPOY-JQWIXIFHSA-N.svg)
2-Pyrrolidinecarboxamide, N-[(1S)-1-phenylethyl]-, (2S)-
CAS 149673-13-2C13H18N2O
N-(3,4-Dimethoxybenzyl)pyrrolidine-2-carboxamide oxalate
C16H22N2O7
![N-[(2-Chlorophenyl)methyl]pyrrolidine-2-carboxamide chemical structure, C12H15ClN2O, CAS 403478-98-8](/s/SXJUKWWQCOQQKI-UHFFFAOYSA-N.svg)
N-[(2-Chlorophenyl)methyl]pyrrolidine-2-carboxamide
CAS 403478-98-8C12H15ClN2O
N-(2-Fluorobenzyl)pyrrolidine-2-carboxamide
CAS 1464015-28-8C12H15FN2O
N-(1-Phenylethyl)pyrrolidine-2-carboxamide
C13H18N2O
Ethyl 5-(Benzylcarbamoyl)-1-methylpyrrolidine-2-carboxylate
CAS 97021-00-6C16H22N2O3
N-(4-Fluorobenzyl)pyrrolidine-2-carboxamide
CAS 1491643-53-8C12H15FN2O
![N-[(2-Methylphenyl)methyl]pyrrolidine-2-carboxamide chemical structure, C13H18N2O, CAS 1250566-72-3](/s/GIZSAZMSNKEJAE-UHFFFAOYSA-N.svg)
N-[(2-Methylphenyl)methyl]pyrrolidine-2-carboxamide
CAS 1250566-72-3C13H18N2O
N-Benzyl-2-pyrrolidinecarboxamide hydrochloride
CAS 1236255-21-2C12H17ClN2O
D-Leucyl-N-(4-carbamimidoylbenzyl)-L-prolinamide
CAS 1186647-77-7C19H29N5O2
(R)-tert-Butyl 2-((4-chlorobenzyl)carbamoyl)pyrrolidine-1-carboxylate
CAS 1140495-84-6C17H23ClN2O3
N-(2-Fluorobenzyl)-N-methylpyrrolidine-2-carboxamide
CAS 1219187-72-0C13H17FN2O
N-(3-Fluoro-4-methylbenzyl)pyrrolidine-2-carboxamide
CAS 1583998-40-6C13H17FN2O
N-Benzyl-N-ethylpyrrolidine-2-carboxamide
CAS 1132880-62-6C14H20N2O
N-(3-Fluorobenzyl)pyrrolidine-2-carboxamide
CAS 1487369-35-6C12H15FN2O
![tert-Butyl 2-{[(4-fluorophenyl)methyl]carbamoyl}pyrrolidine-1-carboxylate chemical structure, C17H23FN2O3, CAS 1219385-06-4](/s/FDNWBTJHCGBNLS-UHFFFAOYSA-N.svg)
tert-Butyl 2-{[(4-fluorophenyl)methyl]carbamoyl}pyrrolidine-1-carboxylate
CAS 1219385-06-4C17H23FN2O3
(2S)-N-Benzylpyrrolidine-2-carboxamide hydrochloride
CAS 140670-72-0C12H17ClN2O
- N-Benzyl-N-methyl-2-pyrrolidinecarboxamide hydrochloride1246172-87-1C13H19ClN2O
- N-Benzyl-N-ethyl-2-pyrrolidinecarboxamide hydrochloride1236266-52-6C14H21ClN2O
- (S)-2-(4-Bromobenzylcarbamoyl)pyrrolidine-1-carboxylic acid tert-butyl ester1240427-85-3C17H23BrN2O3
- N-[2-(Dimethylamino)-1-phenylethyl]pyrrolidine-2-carboxamide1291168-97-2C15H23N3O
- N-[(4-Bromophenyl)methyl]-2-methylprolinamide1378577-20-8C13H17BrN2O
- 2-(4-Bromo-benzylcarbamoyl)-pyrrolidine-1-carboxylic acid tert-butyl ester2197427-85-1C17H23BrN2O3
- tert-Butyl(2R,4R)-2-(benzylcarbamoyl)-4-hydroxypyrrolidine-1-carboxylate1266230-15-2C17H24N2O4
- tert-Butyl (2S)-2-[2-(2-amino-4-bromophenyl)propan-2-ylcarbamoyl]pyrrolidine-1-carboxylate1357259-28-9C19H28BrN3O3
- tert-Butyl (2S)-2-[2-(4-bromo-2-nitrophenyl)propan-2-ylcarbamoyl]pyrrolidine-1-carboxylate1357259-27-8C19H26BrN3O5
- (2S,3R)-2-(3-Chloro-2-fluoro-benzylcarbamoyl)-3-methoxy-pyrrolidine-1-carboxylic acid tert-butyl ester1386457-98-2C18H24ClFN2O4
- N-Benzyl-2-methyl-L-prolinamide394657-03-5C13H18N2O
- N-[(2-Methylphenyl)methyl]pyrrolidine-2-carboxamide hydrochloride1423025-10-8C13H19ClN2O
- 2-Ethyl-N-[(2-methoxyphenyl)methyl]-N-methylprolinamide1551051-58-1C16H24N2O2
- N-(2,3-Dimethylbenzyl)pyrrolidine-2-carboxamide1505030-03-4C14H20N2O
- (2S)-1-Acetyl-N-[(4-tert-butylphenyl)-cyanomethyl]pyrrolidine-2-carboxamide1465289-59-1C19H25N3O2
- tert-Butyl (R)-2-((4-cyanobenzyl)carbamoyl)pyrrolidine-1-carboxylate2301884-81-9C18H23N3O3
- (2S,4R)-tert-Butyl 2-((4-bromobenzyl)carbamoyl)-4-hydroxypyrrolidine-1-carboxylate1448189-89-6C17H23BrN2O4
- N-[2-(Dimethylamino)-1-phenylethyl]pyrrolidine-2-carboxamide dihydrochloride1803571-93-8C15H25Cl2N3O
- (R)-N-(4-Bromobenzyl)pyrrolidine-2-carboxamide hydrochloride2989084-67-3C12H16BrClN2O
- (S)-N-(4-Bromobenzyl)pyrrolidine-2-carboxamide hydrochloride1596195-59-3C12H16BrClN2O
- (R)-N-(3-Bromobenzyl)pyrrolidine-2-carboxamide hydrochloride2988187-26-2C12H16BrClN2O
- (S)-N-(3-Bromobenzyl)pyrrolidine-2-carboxamide hydrochloride1606786-71-3C12H16BrClN2O
- tert-Butyl ((S)-1-((2S,4R)-2-((4-bromobenzyl)carbamoyl)-4-hydroxypyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)carbamate1951445-17-2C23H34BrN3O5
- (2S,4R)-N-(4-Bromobenzyl)-4-hydroxypyrrolidine-2-carboxamide1951445-11-6C12H15BrN2O2
Related scaffolds
Same ring framework with different atoms or bond orders
O=C(OCc1ccccc1)N1CCCC161 chemicals
O=C(NCc1ccco1)c1ccccc158 chemicals
O=C(Cc1cccs1)Nc1ccccc141 chemicals
O=C(NCC1CCCO1)c1ccccc138 chemicals
O=C(NCC1CCCN1)c1ccccc138 chemicals
O=C(Cc1ccccc1)Nc1nccs137 chemicals
O=S(=O)(NCc1ccco1)c1ccccc136 chemicals
O=S(=O)(NCC1CCCO1)c1ccccc134 chemicals
O=C(NCc1ccccc1)c1ccco130 chemicals
O=C(NCc1ccccc1)c1cccs128 chemicals
c1ccc(CNCc2ccco2)cc128 chemicals![Scaffold O=C(NCc1ccccc1)c1ccc[nH]1](/scaffold/PSYQATYJXPGBDC-UHFFFAOYSA-N/structure.svg)
O=C(NCc1ccccc1)c1ccc[nH]125 chemicals