N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide

C14H14N2O2 — CID 107261392

IUPACN-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccc(=O)[nH]2)cc1C
InChIInChI=1S/C14H14N2O2/c1-9-6-7-11(8-10(9)2)15-14(18)12-4-3-5-13(17)16-12/h3-8H,1-2H3,(H,15,18)(H,16,17)
InChIKeyWBGJURAIXVHJMI-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.24
Rot. Bonds2

About N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide

N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 107261392) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide
PubChem CID107261392
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC NameN-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccc(=O)[nH]2)cc1C
InChIInChI=1S/C14H14N2O2/c1-9-6-7-11(8-10(9)2)15-14(18)12-4-3-5-13(17)16-12/h3-8H,1-2H3,(H,15,18)(H,16,17)
InChIKeyWBGJURAIXVHJMI-UHFFFAOYSA-N
XLogP2.24
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide (CID 107261392) is N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide is Cc1ccc(NC(=O)c2cccc(=O)[nH]2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is WBGJURAIXVHJMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-9-6-7-11(8-10(9)2)15-14(18)12-4-3-5-13(17)16-12/h3-8H,1-2H3,(H,15,18)(H,16,17).
What are the key properties of N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide?
N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 2.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 107261392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).