N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide

C16H13ClN2O — CID 66255832

IUPACN-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide
SMILESCc1cccc(Cl)c1NC(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C16H13ClN2O/c1-10-3-2-4-13(17)15(10)19-16(20)12-6-5-11-7-8-18-14(11)9-12/h2-9,18H,1H3,(H,19,20)
InChIKeyMBPGODIFHHNOBH-UHFFFAOYSA-N
MW284.75 g/mol
LogP4.38
Rot. Bonds2

About N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide

N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide (PubChem CID 66255832) has the molecular formula C16H13ClN2O and a molecular weight of 284.75 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide
PubChem CID66255832
Molecular FormulaC16H13ClN2O
Molecular Weight284.75 g/mol
Exact Mass284.07
IUPAC NameN-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide
SMILESCc1cccc(Cl)c1NC(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C16H13ClN2O/c1-10-3-2-4-13(17)15(10)19-16(20)12-6-5-11-7-8-18-14(11)9-12/h2-9,18H,1H3,(H,19,20)
InChIKeyMBPGODIFHHNOBH-UHFFFAOYSA-N
XLogP4.38
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.75
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze N-(2-chloro-6-methylphenyl)-1H-indole-6-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-ethyl-6-methylphenyl)-1H-indole-6-carboxamide
CID 60773719
N-(2-chloro-4-methyl-3-pyridinyl)-1H-indole-6-carboxamide
CID 65490101
N-(2-chloro-6-methylphenyl)-3-hydroxy-4-methylbenzamide
CID 66254574
4-bromo-3-chloro-N-(2-chloro-6-methylphenyl)benzamide
CID 81002737
3-[(2-chloro-6-methylphenyl)carbamoyl]benzoic acid
CID 66254685
N-(2-chloro-6-methylphenyl)-3-hydroxy-4-iodobenzamide
CID 104629237
4-tert-butyl-N-(2-chloro-6-methylphenyl)benzamide
CID 721211
N-(2-chloro-6-methylphenyl)-4-fluoro-3-sulfanylbenzamide
CID 107031792
N-(2-chloro-6-methylphenyl)-4-methyl-3-nitrobenzamide
CID 711319
2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide
CID 4548334
N-(3-methyl-4-pyridinyl)-1H-indole-6-carboxamide
CID 63709047
N-(4-methyl-3-pyridinyl)-1H-indole-6-carboxamide
CID 55225910

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide?
The IUPAC name of N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide (CID 66255832) is N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide is Cc1cccc(Cl)c1NC(=O)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide?
The InChIKey is MBPGODIFHHNOBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2O/c1-10-3-2-4-13(17)15(10)19-16(20)12-6-5-11-7-8-18-14(11)9-12/h2-9,18H,1H3,(H,19,20).
What are the key properties of N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide?
N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide has a molecular weight of 284.75 g/mol, XLogP of 4.38, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-1H-indole-6-carboxamide is sourced from PubChem (CID 66255832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).