1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide

C25H28N2O2 — CID 23040088

IUPAC1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1c(CC(C)C)n(Cc2ccccc2)c(C)cc1=O
InChIInChI=1S/C25H28N2O2/c1-17(2)14-22-24(25(29)26-21-13-9-8-10-18(21)3)23(28)15-19(4)27(22)16-20-11-6-5-7-12-20/h5-13,15,17H,14,16H2,1-4H3,(H,26,29)
InChIKeyBCJFNKOGYBZBPJ-UHFFFAOYSA-N
MW388.51 g/mol
LogP4.96
Rot. Bonds6

About 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide

1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide (PubChem CID 23040088) has the molecular formula C25H28N2O2 and a molecular weight of 388.51 g/mol. Its IUPAC name is 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
PubChem CID23040088
Molecular FormulaC25H28N2O2
Molecular Weight388.51 g/mol
Exact Mass388.22
IUPAC Name1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1c(CC(C)C)n(Cc2ccccc2)c(C)cc1=O
InChIInChI=1S/C25H28N2O2/c1-17(2)14-22-24(25(29)26-21-13-9-8-10-18(21)3)23(28)15-19(4)27(22)16-20-11-6-5-7-12-20/h5-13,15,17H,14,16H2,1-4H3,(H,26,29)
InChIKeyBCJFNKOGYBZBPJ-UHFFFAOYSA-N
XLogP4.96
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.51
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-phenylpyridine-3-carboxamide
CID 14252502
N-(2,3-dimethylphenyl)-1-(furan-2-ylmethyl)-6-methyl-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
CID 23040280
N-(2-chlorophenyl)-1-(furan-2-ylmethyl)-6-methyl-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
CID 23040785
N-(2-chlorophenyl)-6-methyl-2-(2-methylpropyl)-4-oxo-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 23040152
1-benzyl-N-(2-methylphenyl)-4-oxo-2,6-dipropylpyridine-3-carboxamide
CID 23037900
6-methyl-N-(2-methylphenyl)-4-oxo-2-pentyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040324
1-benzyl-N-(2-chlorophenyl)-6-methyl-2-(2-methylphenyl)-4-oxopyridine-3-carboxamide
CID 23040717
N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide
CID 23040750
1-(cyclohexylmethyl)-N-(2,3-dimethylphenyl)-6-methyl-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
CID 23040938
2-butyl-N-(2-chlorophenyl)-6-methyl-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040327
2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040873
1-[(4-chlorophenyl)methyl]-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide
CID 23040883

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide?
The IUPAC name of 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide (CID 23040088) is 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide?
The canonical SMILES for 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide is Cc1ccccc1NC(=O)c1c(CC(C)C)n(Cc2ccccc2)c(C)cc1=O.
What is the InChIKey of 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide?
The InChIKey is BCJFNKOGYBZBPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O2/c1-17(2)14-22-24(25(29)26-21-13-9-8-10-18(21)3)23(28)15-19(4)27(22)16-20-11-6-5-7-12-20/h5-13,15,17H,14,16H2,1-4H3,(H,26,29).
What are the key properties of 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide?
1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide has a molecular weight of 388.51 g/mol, XLogP of 4.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 23040088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).