1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide

C23H25N3O2 — CID 23040109

IUPAC1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide
SMILESCCCCn1c(C)cc(=O)c(C(=O)Nc2ccccc2C)c1-c1cccnc1
InChIInChI=1S/C23H25N3O2/c1-4-5-13-26-17(3)14-20(27)21(22(26)18-10-8-12-24-15-18)23(28)25-19-11-7-6-9-16(19)2/h6-12,14-15H,4-5,13H2,1-3H3,(H,25,28)
InChIKeyJDWRVNLTLMKAMS-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.58
Rot. Bonds6

About 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide

1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide (PubChem CID 23040109) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide
PubChem CID23040109
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC Name1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide
SMILESCCCCn1c(C)cc(=O)c(C(=O)Nc2ccccc2C)c1-c1cccnc1
InChIInChI=1S/C23H25N3O2/c1-4-5-13-26-17(3)14-20(27)21(22(26)18-10-8-12-24-15-18)23(28)25-19-11-7-6-9-16(19)2/h6-12,14-15H,4-5,13H2,1-3H3,(H,25,28)
InChIKeyJDWRVNLTLMKAMS-UHFFFAOYSA-N
XLogP4.58
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-yl-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 23040556
1-[(4-chlorophenyl)methyl]-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide
CID 23040883
6-methyl-N-(2-methylphenyl)-4-oxo-1-pentyl-2-pyridin-2-ylpyridine-3-carboxamide
CID 23040237
6-methyl-N-(2-methylphenyl)-4-oxo-2-pentyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040324
1-benzyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-phenylpyridine-3-carboxamide
CID 14252502
N-(2-chlorophenyl)-1-hexyl-6-methyl-2-(2-methylphenyl)-4-oxopyridine-3-carboxamide
CID 23040741
N-(2,6-diethylphenyl)-6-methyl-1-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide
CID 23040502
2-butyl-N-(2-chlorophenyl)-6-methyl-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040327
2-(3-chlorophenyl)-6-methyl-4-oxo-1-pentyl-N-phenylpyridine-3-carboxamide
CID 23040917
2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040873
2-(2-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methyl-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040706
N-(2-methylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 52986112

Frequently Asked Questions

What is the IUPAC name of 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide?
The IUPAC name of 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide (CID 23040109) is 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide.
What is the SMILES notation for 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide?
The canonical SMILES for 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide is CCCCn1c(C)cc(=O)c(C(=O)Nc2ccccc2C)c1-c1cccnc1.
What is the InChIKey of 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide?
The InChIKey is JDWRVNLTLMKAMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-4-5-13-26-17(3)14-20(27)21(22(26)18-10-8-12-24-15-18)23(28)25-19-11-7-6-9-16(19)2/h6-12,14-15H,4-5,13H2,1-3H3,(H,25,28).
What are the key properties of 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide?
1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 4.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide is sourced from PubChem (CID 23040109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).