N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide

C15H16N2O4 — CID 75448038

IUPACN-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2c[nH]cc(C)c2=O)c1
InChIInChI=1S/C15H16N2O4/c1-9-7-16-8-11(14(9)18)15(19)17-12-6-10(20-2)4-5-13(12)21-3/h4-8H,1-3H3,(H,16,18)(H,17,19)
InChIKeyLYFLSQJWKCOTAX-UHFFFAOYSA-N
MW288.30 g/mol
LogP1.95
Rot. Bonds4

About N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide

N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 75448038) has the molecular formula C15H16N2O4 and a molecular weight of 288.30 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID75448038
Molecular FormulaC15H16N2O4
Molecular Weight288.30 g/mol
Exact Mass288.11
IUPAC NameN-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2c[nH]cc(C)c2=O)c1
InChIInChI=1S/C15H16N2O4/c1-9-7-16-8-11(14(9)18)15(19)17-12-6-10(20-2)4-5-13(12)21-3/h4-8H,1-3H3,(H,16,18)(H,17,19)
InChIKeyLYFLSQJWKCOTAX-UHFFFAOYSA-N
XLogP1.95
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide (CID 75448038) is N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide is COc1ccc(OC)c(NC(=O)c2c[nH]cc(C)c2=O)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is LYFLSQJWKCOTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4/c1-9-7-16-8-11(14(9)18)15(19)17-12-6-10(20-2)4-5-13(12)21-3/h4-8H,1-3H3,(H,16,18)(H,17,19).
What are the key properties of N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide?
N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 288.30 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-5-methyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 75448038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).