1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide

C15H16N2O2 — CID 154381681

IUPAC1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide
SMILESCc1cn(Cc2ccccc2)c(C)c(C(N)=O)c1=O
InChIInChI=1S/C15H16N2O2/c1-10-8-17(9-12-6-4-3-5-7-12)11(2)13(14(10)18)15(16)19/h3-8H,9H2,1-2H3,(H2,16,19)
InChIKeyJVARFRRNWUSQAI-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.61
Rot. Bonds3

About 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide

1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide (PubChem CID 154381681) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide
PubChem CID154381681
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide
SMILESCc1cn(Cc2ccccc2)c(C)c(C(N)=O)c1=O
InChIInChI=1S/C15H16N2O2/c1-10-8-17(9-12-6-4-3-5-7-12)11(2)13(14(10)18)15(16)19/h3-8H,9H2,1-2H3,(H2,16,19)
InChIKeyJVARFRRNWUSQAI-UHFFFAOYSA-N
XLogP1.61
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
CID 3620214
1-benzyl-4,6-dimethyl-2-oxopyridine-3-carboxamide
CID 23855308
1-benzyl-4-methyl-3-(4-methylphenyl)pyrrole-2-carboxylic acid
CID 67147752
1-benzyl-5-hydroxy-2,6-dimethylindole-3-carboxamide
CID 3852732
1-benzyl-2,5-dimethyl-4-(4-methylphenyl)pyrrole-3-carboxamide
CID 3458607
1-benzyl-2,5-dimethylpyrrole-3-carboxamide
CID 47108355
2-benzyl-4-methyl-5,6,7,8-tetrahydroisoquinolin-1-one
CID 123599433
1-benzyl-5-hydroxy-2-methylindole-3-carboxamide
CID 3843286
1-benzyl-5-ethyl-2-methyl-4-(4-methylphenyl)pyrrole-3-carboxamide
CID 3797302
1-benzyl-4,5,6,7-tetrafluoro-3-methylindole
CID 15584719
1-[(3-benzyl-5-methyl-2,6-dioxopyrimidin-1-yl)methyl]cyclopropane-1-carboxylic acid
CID 54554001
1-benzyl-4-[4-(dimethylamino)phenyl]-2,5-dimethylpyrrole-3-carboxamide
CID 4669918

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide?
The IUPAC name of 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide (CID 154381681) is 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide?
The canonical SMILES for 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide is Cc1cn(Cc2ccccc2)c(C)c(C(N)=O)c1=O.
What is the InChIKey of 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide?
The InChIKey is JVARFRRNWUSQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-8-17(9-12-6-4-3-5-7-12)11(2)13(14(10)18)15(16)19/h3-8H,9H2,1-2H3,(H2,16,19).
What are the key properties of 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide?
1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2,5-dimethyl-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 154381681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).