N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide

C19H18N2O2 — CID 69445167

IUPACN-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
SMILESCc1cc(C)c2[nH]c(=O)c(CNC(=O)c3ccccc3)cc2c1
InChIInChI=1S/C19H18N2O2/c1-12-8-13(2)17-15(9-12)10-16(19(23)21-17)11-20-18(22)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyYKISMKBUIXVESD-UHFFFAOYSA-N
MW306.36 g/mol
LogP3.07
Rot. Bonds3

About N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide

N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide (PubChem CID 69445167) has the molecular formula C19H18N2O2 and a molecular weight of 306.36 g/mol. Its IUPAC name is N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide.

Molecular Properties

Compound NameN-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
PubChem CID69445167
Molecular FormulaC19H18N2O2
Molecular Weight306.36 g/mol
Exact Mass306.14
IUPAC NameN-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
SMILESCc1cc(C)c2[nH]c(=O)c(CNC(=O)c3ccccc3)cc2c1
InChIInChI=1S/C19H18N2O2/c1-12-8-13(2)17-15(9-12)10-16(19(23)21-17)11-20-18(22)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyYKISMKBUIXVESD-UHFFFAOYSA-N
XLogP3.07
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.36
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-fluorobenzamide
CID 110325266
2-bromo-N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 110325268
N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
CID 110325301
N-[2-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-methylbenzamide
CID 110326259
N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenoxypropanamide
CID 110325288
6,8-dimethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2-oxo-1H-quinoline-3-carboxamide
CID 110616698
N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]pentanamide
CID 69447803
N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-methylbutanamide
CID 110325256
1-[2-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-phenylurea
CID 110326282
3-[(2-methoxyanilino)methyl]-6,8-dimethyl-1H-quinolin-2-one
CID 864735
N-[[5-(benzamidomethyl)-2,4-dimethylphenyl]methyl]benzamide
CID 154149793
3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)-N-(1-phenylethyl)propanamide
CID 110331547

Frequently Asked Questions

What is the IUPAC name of N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The IUPAC name of N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide (CID 69445167) is N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide.
What is the SMILES notation for N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The canonical SMILES for N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide is Cc1cc(C)c2[nH]c(=O)c(CNC(=O)c3ccccc3)cc2c1.
What is the InChIKey of N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide?
The InChIKey is YKISMKBUIXVESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-12-8-13(2)17-15(9-12)10-16(19(23)21-17)11-20-18(22)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide?
N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide has a molecular weight of 306.36 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide is sourced from PubChem (CID 69445167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).