6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide

C16H11ClN2O2 — CID 17016504

IUPAC6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide
SMILESO=C(Nc1ccccc1)c1c[nH]c2ccc(Cl)cc2c1=O
InChIInChI=1S/C16H11ClN2O2/c17-10-6-7-14-12(8-10)15(20)13(9-18-14)16(21)19-11-4-2-1-3-5-11/h1-9H,(H,18,20)(H,19,21)
InChIKeyUQEZCQZQEKQSNB-UHFFFAOYSA-N
MW298.73 g/mol
LogP3.43
Rot. Bonds2

About 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide

6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide (PubChem CID 17016504) has the molecular formula C16H11ClN2O2 and a molecular weight of 298.73 g/mol. Its IUPAC name is 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide
PubChem CID17016504
Molecular FormulaC16H11ClN2O2
Molecular Weight298.73 g/mol
Exact Mass298.05
IUPAC Name6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide
SMILESO=C(Nc1ccccc1)c1c[nH]c2ccc(Cl)cc2c1=O
InChIInChI=1S/C16H11ClN2O2/c17-10-6-7-14-12(8-10)15(20)13(9-18-14)16(21)19-11-4-2-1-3-5-11/h1-9H,(H,18,20)(H,19,21)
InChIKeyUQEZCQZQEKQSNB-UHFFFAOYSA-N
XLogP3.43
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.73
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-N-(3,5-difluorophenyl)-4-oxo-1H-quinoline-3-carboxamide
CID 17016539
N-(3-chlorophenyl)-6-fluoro-4-oxo-1H-quinoline-3-carboxamide
CID 39849727
ethyl 6-[(6-chloro-4-oxo-1H-quinoline-3-carbonyl)amino]-4-oxo-1H-quinoline-3-carboxylate
CID 39850158
6-fluoro-N-(4-fluorophenyl)-4-oxo-1H-quinoline-3-carboxamide
CID 39849776
N-(3-acetylphenyl)-5-chloro-1H-indole-3-carboxamide
CID 113205903
6-chloro-4-oxo-1H-quinoline-3-carboxamide
CID 601266
2-(6-chloro-1H-indol-3-yl)-2-oxo-N-phenylacetamide
CID 54771139
3-[(4-oxo-1H-quinoline-3-carbonyl)amino]benzoic acid
CID 679194
5-amino-N-phenyl-1H-indole-3-carboxamide
CID 63116510
4-oxo-7-(phenylcarbamoyl)-1H-quinoline-3-carboxylic acid
CID 11500516
N-(3-bromophenyl)-6-fluoro-4-oxo-1H-quinoline-3-carboxamide
CID 39849718
5-chloro-N-(4-pyrrolidin-1-ylphenyl)-1H-indole-3-carboxamide
CID 113205913

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide?
The IUPAC name of 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide (CID 17016504) is 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide.
What is the SMILES notation for 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide?
The canonical SMILES for 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide is O=C(Nc1ccccc1)c1c[nH]c2ccc(Cl)cc2c1=O.
What is the InChIKey of 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide?
The InChIKey is UQEZCQZQEKQSNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN2O2/c17-10-6-7-14-12(8-10)15(20)13(9-18-14)16(21)19-11-4-2-1-3-5-11/h1-9H,(H,18,20)(H,19,21).
What are the key properties of 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide?
6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide has a molecular weight of 298.73 g/mol, XLogP of 3.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-oxo-N-phenyl-1H-quinoline-3-carboxamide is sourced from PubChem (CID 17016504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).