N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide

C20H19N3O2 — CID 95327025

IUPACN-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide
SMILESO=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C20H19N3O2/c24-19-11-17(13-23(19)12-14-4-2-1-3-5-14)22-20(25)16-7-6-15-8-9-21-18(15)10-16/h1-10,17,21H,11-13H2,(H,22,25)/t17-/m1/s1
InChIKeyMQPFRUBAZKGRRN-QGZVFWFLSA-N
MW333.39 g/mol
LogP2.70
Rot. Bonds4

About N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide

N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide (PubChem CID 95327025) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide
PubChem CID95327025
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide
SMILESO=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C20H19N3O2/c24-19-11-17(13-23(19)12-14-4-2-1-3-5-14)22-20(25)16-7-6-15-8-9-21-18(15)10-16/h1-10,17,21H,11-13H2,(H,22,25)/t17-/m1/s1
InChIKeyMQPFRUBAZKGRRN-QGZVFWFLSA-N
XLogP2.70
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-3-cyanobenzamide
CID 95334504
N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1-methyl-6-oxopyridine-3-carboxamide
CID 95335220
N-(1-benzyl-5-oxopyrrolidin-3-yl)-6-methylpyridine-3-carboxamide
CID 56826631
N-(azetidin-3-yl)-1H-indole-6-carboxamide
CID 66186513
N-[(3S)-1-benzyl-5-oxopyrrolidin-3-yl]-6-methylpyridine-2-carboxamide
CID 95594104
N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-1H-indole-5-carboxamide
CID 10713693
N-cyclohexyl-1H-indole-6-carboxamide
CID 39706974
N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-3-yl]-1H-indole-6-carboxamide
CID 31053727
N-[(3R)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidin-3-yl]-3-methoxybenzamide
CID 42528068
N-(1-benzyl-5-oxopyrrolidin-3-yl)-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 72905508
1-(4-acetylphenyl)-3-(1-benzyl-5-oxopyrrolidin-3-yl)urea
CID 108876474
N-[(3S)-1-benzyl-5-oxopyrrolidin-3-yl]-2-chloro-6-fluorobenzamide
CID 95324569

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide?
The IUPAC name of N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide (CID 95327025) is N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide.
What is the SMILES notation for N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide?
The canonical SMILES for N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide is O=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide?
The InChIKey is MQPFRUBAZKGRRN-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H19N3O2/c24-19-11-17(13-23(19)12-14-4-2-1-3-5-14)22-20(25)16-7-6-15-8-9-21-18(15)10-16/h1-10,17,21H,11-13H2,(H,22,25)/t17-/m1/s1.
What are the key properties of N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide?
N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-benzyl-5-oxopyrrolidin-3-yl]-1H-indole-6-carboxamide is sourced from PubChem (CID 95327025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).