N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide

C17H16N2O2 — CID 60933429

IUPACN-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide
SMILESCOc1cc(C)ccc1NC(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C17H16N2O2/c1-11-7-8-15(16(9-11)21-2)19-17(20)13-10-18-14-6-4-3-5-12(13)14/h3-10,18H,1-2H3,(H,19,20)
InChIKeyQWPCCYHCUJWJJS-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.74
Rot. Bonds3

About N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide

N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide (PubChem CID 60933429) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide
PubChem CID60933429
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC NameN-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide
SMILESCOc1cc(C)ccc1NC(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C17H16N2O2/c1-11-7-8-15(16(9-11)21-2)19-17(20)13-10-18-14-6-4-3-5-12(13)14/h3-10,18H,1-2H3,(H,19,20)
InChIKeyQWPCCYHCUJWJJS-UHFFFAOYSA-N
XLogP3.74
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-methoxy-4-methylphenyl)-1H-indole-3-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

N-(2-methoxy-4-methylphenyl)naphthalene-1-carboxamide
CID 66596351
N-(3,5-dimethylphenyl)-1H-indole-3-carboxamide
CID 43399253
N-(2,4-dimethylphenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206042
6-amino-N-(2-methoxyphenyl)-1H-indole-3-carboxamide
CID 61089726
N-(6-chloro-2-methyl-3-pyridinyl)-1H-indole-3-carboxamide
CID 107301351
N-(2-hydroxyphenyl)-1H-indole-3-carboxamide
CID 57210773
N-(2-bromo-4-methylphenyl)-5-methoxy-1H-indole-3-carboxamide
CID 113206110
N-(3,4-dimethylphenyl)-1H-indole-3-carboxamide
CID 43399217
N'-(3,4,5-trimethoxybenzoyl)-1H-indole-3-carbohydrazide
CID 30455105
4,5,6-trimethoxy-N-(2-methoxy-5-methylphenyl)-1H-indole-3-carboxamide
CID 113206816
2-bromo-N-(2-methoxy-4-methylphenyl)-3-methylbenzamide
CID 103853431
4-amino-N-(2-methoxy-4-methylphenyl)-1H-pyrrole-2-carboxamide
CID 61117898

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide?
The IUPAC name of N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide (CID 60933429) is N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide.
What is the SMILES notation for N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide?
The canonical SMILES for N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide is COc1cc(C)ccc1NC(=O)c1c[nH]c2ccccc12.
What is the InChIKey of N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide?
The InChIKey is QWPCCYHCUJWJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-11-7-8-15(16(9-11)21-2)19-17(20)13-10-18-14-6-4-3-5-12(13)14/h3-10,18H,1-2H3,(H,19,20).
What are the key properties of N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide?
N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-4-methylphenyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 60933429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).