N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide

C19H18N2O2 — CID 110694516

IUPACN-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
SMILESCc1ccc(NC(=O)c2cc(=O)n(C)c3ccccc23)c(C)c1
InChIInChI=1S/C19H18N2O2/c1-12-8-9-16(13(2)10-12)20-19(23)15-11-18(22)21(3)17-7-5-4-6-14(15)17/h4-11H,1-3H3,(H,20,23)
InChIKeyJRAUUIGURMNSCB-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.41
Rot. Bonds2

About N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide

N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide (PubChem CID 110694516) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
PubChem CID110694516
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
SMILESCc1ccc(NC(=O)c2cc(=O)n(C)c3ccccc23)c(C)c1
InChIInChI=1S/C19H18N2O2/c1-12-8-9-16(13(2)10-12)20-19(23)15-11-18(22)21(3)17-7-5-4-6-14(15)17/h4-11H,1-3H3,(H,20,23)
InChIKeyJRAUUIGURMNSCB-UHFFFAOYSA-N
XLogP3.41
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694521
1-methyl-N-[(4-methylphenyl)methyl]-2-oxoquinoline-4-carboxamide
CID 110694470
N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694536
1-methyl-2-oxo-N-[4-(phenylcarbamoylamino)phenyl]quinoline-4-carboxamide
CID 55909182
N-[4-(dimethylamino)phenyl]-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694551
N-(4-carbamoylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
CID 91822577
N-(3-chlorophenyl)-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694528
N-(2,4-dimethylphenyl)-3-hydroxy-2-methyl-1-oxoisoquinoline-4-carboxamide
CID 137290391
N-(2,4-dimethylphenyl)-2-phenylquinoline-4-carboxamide
CID 3480982
CID 87065455
CID 87065455
1-methyl-2-oxo-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide
CID 55754361
N-(2,4-dimethylphenyl)-3-methyl-4-oxophthalazine-1-carboxamide
CID 2704863

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide?
The IUPAC name of N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide (CID 110694516) is N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide is Cc1ccc(NC(=O)c2cc(=O)n(C)c3ccccc23)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide?
The InChIKey is JRAUUIGURMNSCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-12-8-9-16(13(2)10-12)20-19(23)15-11-18(22)21(3)17-7-5-4-6-14(15)17/h4-11H,1-3H3,(H,20,23).
What are the key properties of N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide?
N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide is sourced from PubChem (CID 110694516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).