1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide

C19H18N2O2 — CID 53160635

IUPAC1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide
SMILESO=C(NC1CC1)c1ccc2c(c1)CC(=O)N2Cc1ccccc1
InChIInChI=1S/C19H18N2O2/c22-18-11-15-10-14(19(23)20-16-7-8-16)6-9-17(15)21(18)12-13-4-2-1-3-5-13/h1-6,9-10,16H,7-8,11-12H2,(H,20,23)
InChIKeyZHECNTDVYBVFDL-UHFFFAOYSA-N
MW306.37 g/mol
LogP2.67
Rot. Bonds4

About 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide

1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide (PubChem CID 53160635) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide
PubChem CID53160635
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide
SMILESO=C(NC1CC1)c1ccc2c(c1)CC(=O)N2Cc1ccccc1
InChIInChI=1S/C19H18N2O2/c22-18-11-15-10-14(19(23)20-16-7-8-16)6-9-17(15)21(18)12-13-4-2-1-3-5-13/h1-6,9-10,16H,7-8,11-12H2,(H,20,23)
InChIKeyZHECNTDVYBVFDL-UHFFFAOYSA-N
XLogP2.67
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-benzyl-2-oxo-N-propan-2-yl-3H-indole-5-carboxamide
CID 71840675
1-benzyl-2-oxo-3H-indole-5-carboxamide
CID 122479775
1-benzyl-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-3H-indole-5-carboxamide
CID 95100034
4-benzyl-N-cyclooctyl-3-oxo-1,4-benzothiazine-6-carboxamide
CID 4090601
1-benzyl-N-[1-(4-fluorophenyl)ethyl]-2-oxo-3H-indole-5-carboxamide
CID 71840648
5-benzyl-N-cyclopropyl-6-oxobenzo[b][1,4]benzothiazepine-3-carboxamide
CID 5142419
N,1-bis[(4-fluorophenyl)methyl]-2-oxo-3H-indole-5-carboxamide
CID 71840635
N-(4-aminocyclohexyl)-2-benzyl-1,3-dioxoisoindole-5-carboxamide;hydrochloride
CID 119475030
4-[(5-acetyl-2-oxo-3H-indol-1-yl)methyl]benzoic acid
CID 84758253
N-cycloheptyl-1-methyl-2-oxo-3H-indole-5-carboxamide
CID 52986175
N-[(3,5-difluorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-2-oxo-3H-indole-5-carboxamide
CID 71840611
cis-(1R,3S)-3-[(2-benzyl-1,3-dioxoisoindole-5-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120678402

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide?
The IUPAC name of 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide (CID 53160635) is 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide.
What is the SMILES notation for 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide?
The canonical SMILES for 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide is O=C(NC1CC1)c1ccc2c(c1)CC(=O)N2Cc1ccccc1.
What is the InChIKey of 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide?
The InChIKey is ZHECNTDVYBVFDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c22-18-11-15-10-14(19(23)20-16-7-8-16)6-9-17(15)21(18)12-13-4-2-1-3-5-13/h1-6,9-10,16H,7-8,11-12H2,(H,20,23).
What are the key properties of 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide?
1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide is sourced from PubChem (CID 53160635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).