2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide

C15H20N2O2 — CID 42933282

IUPAC2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCCCC(C)NC(=O)C1CC(=O)Nc2ccccc21
InChIInChI=1S/C15H20N2O2/c1-3-6-10(2)16-15(19)12-9-14(18)17-13-8-5-4-7-11(12)13/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyAKRGTYRSNVZRBE-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.42
Rot. Bonds4

About 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide

2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide (PubChem CID 42933282) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide
PubChem CID42933282
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCCCC(C)NC(=O)C1CC(=O)Nc2ccccc21
InChIInChI=1S/C15H20N2O2/c1-3-6-10(2)16-15(19)12-9-14(18)17-13-8-5-4-7-11(12)13/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyAKRGTYRSNVZRBE-UHFFFAOYSA-N
XLogP2.42
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 4616929
(2S)-2-[(2-oxo-3,4-dihydro-1H-quinoline-4-carbonyl)amino]hexanoic acid
CID 120615414
(2S)-2-[[(4S)-2-oxo-3,4-dihydro-1H-quinoline-4-carbonyl]amino]butanoic acid
CID 124684330
(2R)-2-[[(4R)-2-oxo-3,4-dihydro-1H-quinoline-4-carbonyl]amino]butanoic acid
CID 124683658
2-methyl-2-[(2-oxo-3,4-dihydro-1H-quinoline-4-carbonyl)amino]butanoic acid
CID 119199156
(3S)-3-(2-methylphenyl)-3-[[(4R)-2-oxo-3,4-dihydro-1H-quinoline-4-carbonyl]amino]propanoic acid
CID 124695573
N-(2-acetamidoethyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 110702913
2-oxo-N-(2-propan-2-ylphenyl)-3,4-dihydro-1H-quinoline-4-carboxamide
CID 110702917
N-[2-(methylamino)ethyl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride
CID 119503581
2-oxo-N-phenyl-3,4-dihydro-1H-quinoline-4-carboxamide
CID 17493174
N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 154840391
N-(2-methylsulfanylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 46696236

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide?
The IUPAC name of 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide (CID 42933282) is 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide.
What is the SMILES notation for 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide?
The canonical SMILES for 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide is CCCC(C)NC(=O)C1CC(=O)Nc2ccccc21.
What is the InChIKey of 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide?
The InChIKey is AKRGTYRSNVZRBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-6-10(2)16-15(19)12-9-14(18)17-13-8-5-4-7-11(12)13/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide?
2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-pentan-2-yl-3,4-dihydro-1H-quinoline-4-carboxamide is sourced from PubChem (CID 42933282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).