N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide

C18H16N2O2 — CID 2977763

IUPACN-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C18H16N2O2/c1-20(12-13-7-3-2-4-8-13)18(22)15-11-17(21)19-16-10-6-5-9-14(15)16/h2-11H,12H2,1H3,(H,19,21)
InChIKeyWDPYUJTUAUKBQA-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.80
Rot. Bonds3

About N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide

N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 2977763) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide
PubChem CID2977763
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC NameN-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C18H16N2O2/c1-20(12-13-7-3-2-4-8-13)18(22)15-11-17(21)19-16-10-6-5-9-14(15)16/h2-11H,12H2,1H3,(H,19,21)
InChIKeyWDPYUJTUAUKBQA-UHFFFAOYSA-N
XLogP2.80
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[4-(dimethylamino)phenyl]methyl]-N-methyl-2-oxo-1H-quinoline-4-carboxamide
CID 9270290
[2-[benzyl(methyl)amino]-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate
CID 2390297
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-oxo-1H-quinoline-4-carboxamide
CID 26447386
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-oxo-1H-quinoline-4-carboxamide;hydrochloride
CID 119654838
[2-[(4-fluorophenyl)methyl-methylamino]-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate
CID 16529880
methanamine;2-oxo-1H-quinoline-4-carboxylic acid
CID 143703164
N-(1-aminopropan-2-yl)-N-methyl-2-oxo-1H-quinoline-4-carboxamide;hydrochloride
CID 119583320
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-1H-quinoline-4-carboxamide
CID 18119993
[1-(benzylamino)-1-oxopropan-2-yl] 2-oxo-1H-quinoline-4-carboxylate
CID 17409936
N-[3-(dimethylamino)propyl]-2-oxo-1H-quinoline-4-carboxamide
CID 110694434
N-[(2S)-2-(dimethylamino)-2-phenylethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 27230253
N-[2-(dimethylamino)-2-phenylethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 42893716

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide (CID 2977763) is N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide is CN(Cc1ccccc1)C(=O)c1cc(=O)[nH]c2ccccc12.
What is the InChIKey of N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is WDPYUJTUAUKBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-20(12-13-7-3-2-4-8-13)18(22)15-11-17(21)19-16-10-6-5-9-14(15)16/h2-11H,12H2,1H3,(H,19,21).
What are the key properties of N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide?
N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 2977763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).