1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide

C24H24N4O — CID 95571320

IUPAC1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide
SMILESO=C(N[C@@H]1CCC[C@H]1n1ccnc1)c1cc2ccccc2n1Cc1ccccc1
InChIInChI=1S/C24H24N4O/c29-24(26-20-10-6-12-22(20)27-14-13-25-17-27)23-15-19-9-4-5-11-21(19)28(23)16-18-7-2-1-3-8-18/h1-5,7-9,11,13-15,17,20,22H,6,10,12,16H2,(H,26,29)/t20-,22-/m1/s1
InChIKeyFGJACCVOCGVDDD-IFMALSPDSA-N
MW384.48 g/mol
LogP4.41
Rot. Bonds5

About 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide

1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide (PubChem CID 95571320) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide
PubChem CID95571320
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide
SMILESO=C(N[C@@H]1CCC[C@H]1n1ccnc1)c1cc2ccccc2n1Cc1ccccc1
InChIInChI=1S/C24H24N4O/c29-24(26-20-10-6-12-22(20)27-14-13-25-17-27)23-15-19-9-4-5-11-21(19)28(23)16-18-7-2-1-3-8-18/h1-5,7-9,11,13-15,17,20,22H,6,10,12,16H2,(H,26,29)/t20-,22-/m1/s1
InChIKeyFGJACCVOCGVDDD-IFMALSPDSA-N
XLogP4.41
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(2-imidazol-1-ylcyclopentyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 60512615
N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]-1-oxo-2H-isoquinoline-3-carboxamide
CID 95980741
5-chloro-N-(2-imidazol-1-ylcyclopentyl)furan-2-carboxamide
CID 103617988
N-(2-imidazol-1-ylcyclopentyl)-2-(methylamino)acetamide
CID 43713522
2-bromo-4-chloro-N-(2-imidazol-1-ylcyclopentyl)benzamide
CID 103763911
2-amino-N-(2-imidazol-1-ylcyclopentyl)acetamide
CID 43713486
2-bromo-N-(2-imidazol-1-ylcyclopentyl)pyridine-4-carboxamide
CID 103755463
N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]-[1,3]thiazolo[4,5-c]pyridine-2-carboxamide
CID 136587523
ethyl 4-[(1-benzylindole-2-carbonyl)amino]piperidine-1-carboxylate
CID 46491360
3-fluoro-N-[(1S,2R)-2-imidazol-1-ylcyclopentyl]-4-pyrazol-1-ylbenzamide
CID 95572970
1-benzyl-N-[(1-methylpiperidin-4-yl)methyl]indole-2-carboxamide
CID 86877683
(2R)-2-(2-chlorophenyl)-2-hydroxy-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]acetamide
CID 136587530

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide?
The IUPAC name of 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide (CID 95571320) is 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide.
What is the SMILES notation for 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide?
The canonical SMILES for 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide is O=C(N[C@@H]1CCC[C@H]1n1ccnc1)c1cc2ccccc2n1Cc1ccccc1.
What is the InChIKey of 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide?
The InChIKey is FGJACCVOCGVDDD-IFMALSPDSA-N. The full InChI is InChI=1S/C24H24N4O/c29-24(26-20-10-6-12-22(20)27-14-13-25-17-27)23-15-19-9-4-5-11-21(19)28(23)16-18-7-2-1-3-8-18/h1-5,7-9,11,13-15,17,20,22H,6,10,12,16H2,(H,26,29)/t20-,22-/m1/s1.
What are the key properties of 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide?
1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide has a molecular weight of 384.48 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]indole-2-carboxamide is sourced from PubChem (CID 95571320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).