N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide

C17H15N3O3 — CID 110761862

IUPACN-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C17H15N3O3/c18-16(22)12-3-1-2-4-14(12)20-17(23)11-5-7-13-10(9-11)6-8-15(21)19-13/h1-5,7,9H,6,8H2,(H2,18,22)(H,19,21)(H,20,23)
InChIKeyLLQHCUMENWWZEX-UHFFFAOYSA-N
MW309.33 g/mol
LogP1.92
Rot. Bonds3

About N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide

N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide (PubChem CID 110761862) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
PubChem CID110761862
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC NameN-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C17H15N3O3/c18-16(22)12-3-1-2-4-14(12)20-17(23)11-5-7-13-10(9-11)6-8-15(21)19-13/h1-5,7,9H,6,8H2,(H2,18,22)(H,19,21)(H,20,23)
InChIKeyLLQHCUMENWWZEX-UHFFFAOYSA-N
XLogP1.92
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-tert-butylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 110858427
methyl 2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-carbonyl)amino]benzoate
CID 108784479
N-[2-(ethylaminomethyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide;hydrochloride
CID 119439408
[2-[2-(2-methylpropylcarbamoyl)anilino]-2-oxoethyl] 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate
CID 46646037
4-N-(2-carbamoylphenyl)benzene-1,4-dicarboxamide
CID 71944310
4-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)benzamide
CID 43696909
2-[(4-hydroxybenzoyl)amino]benzamide
CID 110462650
N-(4-chloro-2,5-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 24531669
2-benzamidobenzamide
CID 702115
N-(3-bromo-4-pyridinyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 103857166
methyl 5-methyl-3-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]-1H-pyrrole-2-carboxylate
CID 167934437
N-(3-chloro-2-methylphenyl)-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-carboxamide
CID 39889362

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The IUPAC name of N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide (CID 110761862) is N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide is NC(=O)c1ccccc1NC(=O)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The InChIKey is LLQHCUMENWWZEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c18-16(22)12-3-1-2-4-14(12)20-17(23)11-5-7-13-10(9-11)6-8-15(21)19-13/h1-5,7,9H,6,8H2,(H2,18,22)(H,19,21)(H,20,23).
What are the key properties of N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide has a molecular weight of 309.33 g/mol, XLogP of 1.92, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide is sourced from PubChem (CID 110761862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).