N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide

C20H22N2O2 — CID 146123830

IUPACN,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide
SMILESCC(c1ccccc1)N(C)C(=O)C1CC(=O)N(C)c2ccccc21
InChIInChI=1S/C20H22N2O2/c1-14(15-9-5-4-6-10-15)21(2)20(24)17-13-19(23)22(3)18-12-8-7-11-16(17)18/h4-12,14,17H,13H2,1-3H3
InChIKeyFUIBCWKLISYRDU-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.36
Rot. Bonds3

About N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide

N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide (PubChem CID 146123830) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide
PubChem CID146123830
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide
SMILESCC(c1ccccc1)N(C)C(=O)C1CC(=O)N(C)c2ccccc21
InChIInChI=1S/C20H22N2O2/c1-14(15-9-5-4-6-10-15)21(2)20(24)17-13-19(23)22(3)18-12-8-7-11-16(17)18/h4-12,14,17H,13H2,1-3H3
InChIKeyFUIBCWKLISYRDU-UHFFFAOYSA-N
XLogP3.36
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-5-[[methyl-[(4R)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carbonyl]amino]methyl]furan-3-carboxylic acid
CID 125152313
N-[2-(dimethylamino)ethyl]-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110702966
(4R)-N,1-dimethyl-2-oxo-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydroquinoline-4-carboxamide
CID 95883105
N-[1-(3,4-difluorophenyl)ethyl]-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 75459992
(4R)-N-[(1R)-1-(3,4-difluorophenyl)ethyl]-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 33277293
1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide
CID 110702951
N-methyl-5-oxo-1-pentan-3-yl-N-(1-phenylethyl)pyrrolidine-3-carboxamide
CID 112826793
1-methyl-N-(2-methylphenyl)-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110703022
4-[4-(2,2-difluorocyclopropyl)piperidine-1-carbonyl]-1-methyl-3,4-dihydroquinolin-2-one
CID 155957535
(3R)-2-[(4R)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CID 125151108
1-(1-methyl-2-oxo-3,4-dihydroquinoline-4-carbonyl)piperidine-4-carboxamide
CID 110703004
methyl(1-phenylethyl)carbamic acid
CID 67062794

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide?
The IUPAC name of N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide (CID 146123830) is N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide.
What is the SMILES notation for N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide?
The canonical SMILES for N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide is CC(c1ccccc1)N(C)C(=O)C1CC(=O)N(C)c2ccccc21.
What is the InChIKey of N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide?
The InChIKey is FUIBCWKLISYRDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-14(15-9-5-4-6-10-15)21(2)20(24)17-13-19(23)22(3)18-12-8-7-11-16(17)18/h4-12,14,17H,13H2,1-3H3.
What are the key properties of N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide?
N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-2-oxo-N-(1-phenylethyl)-3,4-dihydroquinoline-4-carboxamide is sourced from PubChem (CID 146123830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).