N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide

C25H28N2O2 — CID 23040750

IUPACN-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide
SMILESCCc1c(C(=O)Nc2cccc(C)c2C)c(=O)cc(C)n1Cc1ccc(C)cc1
InChIInChI=1S/C25H28N2O2/c1-6-22-24(25(29)26-21-9-7-8-17(3)19(21)5)23(28)14-18(4)27(22)15-20-12-10-16(2)11-13-20/h7-14H,6,15H2,1-5H3,(H,26,29)
InChIKeyXUCLSFOKEUMGHV-UHFFFAOYSA-N
MW388.51 g/mol
LogP4.94
Rot. Bonds5

About N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide

N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide (PubChem CID 23040750) has the molecular formula C25H28N2O2 and a molecular weight of 388.51 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide
PubChem CID23040750
Molecular FormulaC25H28N2O2
Molecular Weight388.51 g/mol
Exact Mass388.22
IUPAC NameN-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide
SMILESCCc1c(C(=O)Nc2cccc(C)c2C)c(=O)cc(C)n1Cc1ccc(C)cc1
InChIInChI=1S/C25H28N2O2/c1-6-22-24(25(29)26-21-9-7-8-17(3)19(21)5)23(28)14-18(4)27(22)15-20-12-10-16(2)11-13-20/h7-14H,6,15H2,1-5H3,(H,26,29)
InChIKeyXUCLSFOKEUMGHV-UHFFFAOYSA-N
XLogP4.94
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.51
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-chlorophenyl)methyl]-N-(2,3-dimethylphenyl)-6-methyl-2-(2-methylphenyl)-4-oxopyridine-3-carboxamide
CID 23040194
N-(2,3-dimethylphenyl)-1-(furan-2-ylmethyl)-6-methyl-4-oxo-2-propylpyridine-3-carboxamide
CID 23040477
1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
CID 23040088
N-(2,3-dimethylphenyl)-1-(furan-2-ylmethyl)-6-methyl-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
CID 23040280
N-(2,3-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040772
N-(2-chlorophenyl)-6-methyl-1-[(4-methylphenyl)methyl]-4-oxo-2-phenylpyridine-3-carboxamide
CID 139649230
1-benzyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-phenylpyridine-3-carboxamide
CID 14252502
N-(2-chlorophenyl)-2-ethyl-1-hexyl-6-methyl-4-oxopyridine-3-carboxamide
CID 23040770
6-methyl-2-(2-methylphenyl)-1-[(4-methylphenyl)methyl]-4-oxo-N-phenylpyridine-3-carboxamide
CID 23040090
2-(2-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methyl-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040706
1-(cyclohexylmethyl)-N-(2,3-dimethylphenyl)-6-methyl-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
CID 23040938
2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040065

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide (CID 23040750) is N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide is CCc1c(C(=O)Nc2cccc(C)c2C)c(=O)cc(C)n1Cc1ccc(C)cc1.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide?
The InChIKey is XUCLSFOKEUMGHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O2/c1-6-22-24(25(29)26-21-9-7-8-17(3)19(21)5)23(28)14-18(4)27(22)15-20-12-10-16(2)11-13-20/h7-14H,6,15H2,1-5H3,(H,26,29).
What are the key properties of N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide?
N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide has a molecular weight of 388.51 g/mol, XLogP of 4.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-ethyl-6-methyl-1-[(4-methylphenyl)methyl]-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 23040750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).