5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide

C14H13ClN2O4 — CID 110860623

IUPAC5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2c[nH]c(=O)c(Cl)c2)c(OC)c1
InChIInChI=1S/C14H13ClN2O4/c1-20-9-3-4-11(12(6-9)21-2)17-13(18)8-5-10(15)14(19)16-7-8/h3-7H,1-2H3,(H,16,19)(H,17,18)
InChIKeyXCLFNCHGAQRSFS-UHFFFAOYSA-N
MW308.72 g/mol
LogP2.30
Rot. Bonds4

About 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide

5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 110860623) has the molecular formula C14H13ClN2O4 and a molecular weight of 308.72 g/mol. Its IUPAC name is 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID110860623
Molecular FormulaC14H13ClN2O4
Molecular Weight308.72 g/mol
Exact Mass308.06
IUPAC Name5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2c[nH]c(=O)c(Cl)c2)c(OC)c1
InChIInChI=1S/C14H13ClN2O4/c1-20-9-3-4-11(12(6-9)21-2)17-13(18)8-5-10(15)14(19)16-7-8/h3-7H,1-2H3,(H,16,19)(H,17,18)
InChIKeyXCLFNCHGAQRSFS-UHFFFAOYSA-N
XLogP2.30
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.72
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 2832276
methyl 2-[(5-chloro-6-oxo-1H-pyridine-3-carbonyl)amino]benzoate
CID 110861604
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324
N-(2,4-dimethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 18104674
4-amino-N-(2,4-dimethoxyphenyl)benzamide
CID 8566750
3-chloro-N-(2,4-dimethoxyphenyl)thiophene-2-carboxamide
CID 110860597
1-N-(2,4-dimethoxyphenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043198
2-chloro-N-(2,4-dimethoxyphenyl)-4-methylbenzamide
CID 885610
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
N-(2,4-dimethoxyphenyl)-3-hydroxybenzamide
CID 19256865
3-acetamido-N-(2,4-dimethoxyphenyl)-4-methoxybenzamide
CID 110764309
N-(2,4-dimethoxyphenyl)-3-methylbenzamide
CID 710450

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide (CID 110860623) is 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide is COc1ccc(NC(=O)c2c[nH]c(=O)c(Cl)c2)c(OC)c1.
What is the InChIKey of 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is XCLFNCHGAQRSFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O4/c1-20-9-3-4-11(12(6-9)21-2)17-13(18)8-5-10(15)14(19)16-7-8/h3-7H,1-2H3,(H,16,19)(H,17,18).
What are the key properties of 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide?
5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 308.72 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,4-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 110860623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).