6-chloro-1H-indole-3-carboxamide

C9H7ClN2O — CID 130666489

IUPAC6-chloro-1H-indole-3-carboxamide
SMILESNC(=O)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C9H7ClN2O/c10-5-1-2-6-7(9(11)13)4-12-8(6)3-5/h1-4,12H,(H2,11,13)
InChIKeyBHFUALHKBBLRHE-UHFFFAOYSA-N
MW194.62 g/mol
LogP1.92
Rot. Bonds1

About 6-chloro-1H-indole-3-carboxamide

6-chloro-1H-indole-3-carboxamide (PubChem CID 130666489) has the molecular formula C9H7ClN2O and a molecular weight of 194.62 g/mol. Its IUPAC name is 6-chloro-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-chloro-1H-indole-3-carboxamide
PubChem CID130666489
Molecular FormulaC9H7ClN2O
Molecular Weight194.62 g/mol
Exact Mass194.02
IUPAC Name6-chloro-1H-indole-3-carboxamide
SMILESNC(=O)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C9H7ClN2O/c10-5-1-2-6-7(9(11)13)4-12-8(6)3-5/h1-4,12H,(H2,11,13)
InChIKeyBHFUALHKBBLRHE-UHFFFAOYSA-N
XLogP1.92
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.62
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 6-chloro-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

CID 170645729
CID 170645729
2-(6-chloro-1H-indol-3-yl)-2-oxoacetic acid
CID 22556709
(6-chloro-1H-indol-3-yl)-(4-chlorophenyl)methanone
CID 43163471
6-chloro-4-oxo-1H-quinoline-3-carboxamide
CID 601266
6-chloro-N-hydroxy-1H-indole-3-carboximidoyl chloride
CID 137208298
7-chloro-4-oxo-1H-quinoline-3-carbonyl chloride
CID 54380984
7-chloro-3-[2-(6-chloro-1H-indol-3-yl)-2-oxoethoxy]naphthalene-2-carboxamide
CID 121473674
(3-chloro-4-fluorophenyl)-(6-chloro-1H-indol-3-yl)methanone
CID 82875840
1-(6-chloro-1H-indol-3-yl)heptan-1-one
CID 114752147
(4-chloro-3-fluorophenyl)-(6-chloro-1H-indol-3-yl)methanone
CID 107998272
(6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone
CID 43463725
(3-bromo-5-chlorophenyl)-(6-chloro-1H-indol-3-yl)methanone
CID 107949781

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1H-indole-3-carboxamide?
The IUPAC name of 6-chloro-1H-indole-3-carboxamide (CID 130666489) is 6-chloro-1H-indole-3-carboxamide.
What is the SMILES notation for 6-chloro-1H-indole-3-carboxamide?
The canonical SMILES for 6-chloro-1H-indole-3-carboxamide is NC(=O)c1c[nH]c2cc(Cl)ccc12.
What is the InChIKey of 6-chloro-1H-indole-3-carboxamide?
The InChIKey is BHFUALHKBBLRHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O/c10-5-1-2-6-7(9(11)13)4-12-8(6)3-5/h1-4,12H,(H2,11,13).
What are the key properties of 6-chloro-1H-indole-3-carboxamide?
6-chloro-1H-indole-3-carboxamide has a molecular weight of 194.62 g/mol, XLogP of 1.92, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1H-indole-3-carboxamide is sourced from PubChem (CID 130666489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).