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

C14H14N2O4 — CID 107362719

IUPACN-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cccc(=O)[nH]2)c1
InChIInChI=1S/C14H14N2O4/c1-19-9-6-7-12(20-2)11(8-9)16-14(18)10-4-3-5-13(17)15-10/h3-8H,1-2H3,(H,15,17)(H,16,18)
InChIKeyFIRVJNALLWFYEJ-UHFFFAOYSA-N
MW274.28 g/mol
LogP1.64
Rot. Bonds4

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

N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 107362719) has the molecular formula C14H14N2O4 and a molecular weight of 274.28 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide
PubChem CID107362719
Molecular FormulaC14H14N2O4
Molecular Weight274.28 g/mol
Exact Mass274.10
IUPAC NameN-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cccc(=O)[nH]2)c1
InChIInChI=1S/C14H14N2O4/c1-19-9-6-7-12(20-2)11(8-9)16-14(18)10-4-3-5-13(17)15-10/h3-8H,1-2H3,(H,15,17)(H,16,18)
InChIKeyFIRVJNALLWFYEJ-UHFFFAOYSA-N
XLogP1.64
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 51.64
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)-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide (CID 107362719) is N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide is COc1ccc(OC)c(NC(=O)c2cccc(=O)[nH]2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is FIRVJNALLWFYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4/c1-19-9-6-7-12(20-2)11(8-9)16-14(18)10-4-3-5-13(17)15-10/h3-8H,1-2H3,(H,15,17)(H,16,18).
What are the key properties of N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide?
N-(2,5-dimethoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 274.28 g/mol, XLogP of 1.64, 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)-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 107362719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).