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

C20H22N2O2 — CID 24625536

IUPACN-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESCC(C)C(NC(=O)c1ccc2c(c1)CCC(=O)N2)c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-13(2)19(14-6-4-3-5-7-14)22-20(24)16-8-10-17-15(12-16)9-11-18(23)21-17/h3-8,10,12-13,19H,9,11H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRIWUGHVPPJKSLU-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.70
Rot. Bonds4

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

N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide (PubChem CID 24625536) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
PubChem CID24625536
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESCC(C)C(NC(=O)c1ccc2c(c1)CCC(=O)N2)c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-13(2)19(14-6-4-3-5-7-14)22-20(24)16-8-10-17-15(12-16)9-11-18(23)21-17/h3-8,10,12-13,19H,9,11H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRIWUGHVPPJKSLU-UHFFFAOYSA-N
XLogP3.70
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1,2-diphenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 46564543
N-(1-naphthalen-1-ylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 86911762
3,3-dimethyl-2-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]butanoic acid
CID 102553283
(2S)-3-hydroxy-2-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]propanoic acid
CID 102710665
N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide
CID 108784603
2-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]acetic acid
CID 82480129
3-methoxy-2-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]propanoic acid
CID 102710812
N-[(1S)-1-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 98620829
N-(3-aminobutyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 103806261
4-methoxy-2-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]butanoic acid
CID 120703080
N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18143617
3-[(7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]-2-methyl-3-phenylpropanoic acid
CID 120522203

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The IUPAC name of N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide (CID 24625536) is N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide.
What is the SMILES notation for N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The canonical SMILES for N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide is CC(C)C(NC(=O)c1ccc2c(c1)CCC(=O)N2)c1ccccc1.
What is the InChIKey of N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The InChIKey is RIWUGHVPPJKSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-13(2)19(14-6-4-3-5-7-14)22-20(24)16-8-10-17-15(12-16)9-11-18(23)21-17/h3-8,10,12-13,19H,9,11H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 3.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide is sourced from PubChem (CID 24625536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).