1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide

C23H24N2O3 — CID 7598610

IUPAC1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2cccn(Cc3cc(C)ccc3C)c2=O)cc1
InChIInChI=1S/C23H24N2O3/c1-4-28-20-11-9-19(10-12-20)24-22(26)21-6-5-13-25(23(21)27)15-18-14-16(2)7-8-17(18)3/h5-14H,4,15H2,1-3H3,(H,24,26)
InChIKeyUWDIVUJYEFKRIV-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.16
Rot. Bonds6

About 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide

1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide (PubChem CID 7598610) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide
PubChem CID7598610
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC Name1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2cccn(Cc3cc(C)ccc3C)c2=O)cc1
InChIInChI=1S/C23H24N2O3/c1-4-28-20-11-9-19(10-12-20)24-22(26)21-6-5-13-25(23(21)27)15-18-14-16(2)7-8-17(18)3/h5-14H,4,15H2,1-3H3,(H,24,26)
InChIKeyUWDIVUJYEFKRIV-UHFFFAOYSA-N
XLogP4.16
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide (CID 7598610) is 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide is CCOc1ccc(NC(=O)c2cccn(Cc3cc(C)ccc3C)c2=O)cc1.
What is the InChIKey of 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide?
The InChIKey is UWDIVUJYEFKRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-4-28-20-11-9-19(10-12-20)24-22(26)21-6-5-13-25(23(21)27)15-18-14-16(2)7-8-17(18)3/h5-14H,4,15H2,1-3H3,(H,24,26).
What are the key properties of 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide?
1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-dimethylphenyl)methyl]-N-(4-ethoxyphenyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 7598610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).