1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide

C14H18N2O2 — CID 110702951

IUPAC1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide
SMILESCCCNC(=O)C1CC(=O)N(C)c2ccccc21
InChIInChI=1S/C14H18N2O2/c1-3-8-15-14(18)11-9-13(17)16(2)12-7-5-4-6-10(11)12/h4-7,11H,3,8-9H2,1-2H3,(H,15,18)
InChIKeyREIBRPLIPNTXOZ-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.66
Rot. Bonds3

About 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide

1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide (PubChem CID 110702951) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide.

Molecular Properties

Compound Name1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide
PubChem CID110702951
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide
SMILESCCCNC(=O)C1CC(=O)N(C)c2ccccc21
InChIInChI=1S/C14H18N2O2/c1-3-8-15-14(18)11-9-13(17)16(2)12-7-5-4-6-10(11)12/h4-7,11H,3,8-9H2,1-2H3,(H,15,18)
InChIKeyREIBRPLIPNTXOZ-UHFFFAOYSA-N
XLogP1.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(dimethylamino)ethyl]-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110702966
1-methyl-N-(2-methylphenyl)-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110703022
N-(3-acetamidophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110703069
N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110703065
N-(3-chloro-4-methylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110703047
(4S)-1-methyl-N-[[2-(methylsulfanylmethyl)-1,3-thiazol-4-yl]methyl]-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 99929525
2-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)amino]ethylurea
CID 83110177
(4S)-N-(3H-benzimidazol-5-ylmethyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 126453695
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-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-3,4-dihydroquinoline-4-carboxamide
CID 146139808
(3R)-2-[(4R)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CID 125151108

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide?
The IUPAC name of 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide (CID 110702951) is 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide.
What is the SMILES notation for 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide?
The canonical SMILES for 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide is CCCNC(=O)C1CC(=O)N(C)c2ccccc21.
What is the InChIKey of 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide?
The InChIKey is REIBRPLIPNTXOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-3-8-15-14(18)11-9-13(17)16(2)12-7-5-4-6-10(11)12/h4-7,11H,3,8-9H2,1-2H3,(H,15,18).
What are the key properties of 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide?
1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide has a molecular weight of 246.31 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-oxo-N-propyl-3,4-dihydroquinoline-4-carboxamide is sourced from PubChem (CID 110702951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).