5-methyl-N-phenyl-1H-indole-2-carboxamide

C16H14N2O — CID 3254922

IUPAC5-methyl-N-phenyl-1H-indole-2-carboxamide
SMILESCc1ccc2[nH]c(C(=O)Nc3ccccc3)cc2c1
InChIInChI=1S/C16H14N2O/c1-11-7-8-14-12(9-11)10-15(18-14)16(19)17-13-5-3-2-4-6-13/h2-10,18H,1H3,(H,17,19)
InChIKeyPMIAQSIDRIUILX-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.73
Rot. Bonds2

About 5-methyl-N-phenyl-1H-indole-2-carboxamide

5-methyl-N-phenyl-1H-indole-2-carboxamide (PubChem CID 3254922) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 5-methyl-N-phenyl-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-phenyl-1H-indole-2-carboxamide
PubChem CID3254922
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name5-methyl-N-phenyl-1H-indole-2-carboxamide
SMILESCc1ccc2[nH]c(C(=O)Nc3ccccc3)cc2c1
InChIInChI=1S/C16H14N2O/c1-11-7-8-14-12(9-11)10-15(18-14)16(19)17-13-5-3-2-4-6-13/h2-10,18H,1H3,(H,17,19)
InChIKeyPMIAQSIDRIUILX-UHFFFAOYSA-N
XLogP3.73
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-acetylphenyl)-5-methyl-1H-indole-2-carboxamide
CID 110861116
5-methyl-N-[[3-(phenylcarbamoyl)phenyl]methyl]-1H-indole-2-carboxamide
CID 46475216
N-(4-bromo-3-methylphenyl)-5-methyl-1H-indole-2-carboxamide
CID 113207145
5,6-dihydroxy-N-phenyl-1H-indole-2-carboxamide
CID 164610325
N-(4-acetamido-3-methylphenyl)-5-methyl-1H-indole-2-carboxamide
CID 46550602
5-methyl-N-[(1S)-1-phenylethyl]-1H-indole-2-carboxamide
CID 7322417
5-methyl-N-prop-2-enyl-1H-indole-2-carboxamide
CID 4011828
5-methyl-N-[(2S)-4-phenylbutan-2-yl]-1H-indole-2-carboxamide
CID 7322431
3-(5-methyl-1H-indol-2-yl)-3-oxopropanoic acid
CID 165356574
N-(2-hydroxyethyl)-5-methyl-1H-indole-2-carboxamide
CID 89488958
2-[[2-[(5-methyl-1H-indole-2-carbonyl)amino]benzoyl]amino]-3-phenylpropanoic acid
CID 45482486
N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide
CID 26699456

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-phenyl-1H-indole-2-carboxamide?
The IUPAC name of 5-methyl-N-phenyl-1H-indole-2-carboxamide (CID 3254922) is 5-methyl-N-phenyl-1H-indole-2-carboxamide.
What is the SMILES notation for 5-methyl-N-phenyl-1H-indole-2-carboxamide?
The canonical SMILES for 5-methyl-N-phenyl-1H-indole-2-carboxamide is Cc1ccc2[nH]c(C(=O)Nc3ccccc3)cc2c1.
What is the InChIKey of 5-methyl-N-phenyl-1H-indole-2-carboxamide?
The InChIKey is PMIAQSIDRIUILX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-11-7-8-14-12(9-11)10-15(18-14)16(19)17-13-5-3-2-4-6-13/h2-10,18H,1H3,(H,17,19).
What are the key properties of 5-methyl-N-phenyl-1H-indole-2-carboxamide?
5-methyl-N-phenyl-1H-indole-2-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 3.73, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-phenyl-1H-indole-2-carboxamide is sourced from PubChem (CID 3254922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).