N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide

C13H14N2O4S — CID 62873560

IUPACN-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(=O)[nH]c2)c(C)c1
InChIInChI=1S/C13H14N2O4S/c1-9-7-10(19-2)3-5-12(9)15-20(17,18)11-4-6-13(16)14-8-11/h3-8,15H,1-2H3,(H,14,16)
InChIKeyIMKOZEDVMXLYLL-UHFFFAOYSA-N
MW294.33 g/mol
LogP1.49
Rot. Bonds4

About N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide

N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 62873560) has the molecular formula C13H14N2O4S and a molecular weight of 294.33 g/mol. Its IUPAC name is N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID62873560
Molecular FormulaC13H14N2O4S
Molecular Weight294.33 g/mol
Exact Mass294.07
IUPAC NameN-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(=O)[nH]c2)c(C)c1
InChIInChI=1S/C13H14N2O4S/c1-9-7-10(19-2)3-5-12(9)15-20(17,18)11-4-6-13(16)14-8-11/h3-8,15H,1-2H3,(H,14,16)
InChIKeyIMKOZEDVMXLYLL-UHFFFAOYSA-N
XLogP1.49
TPSA88.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluoro-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629227
N-(4-methoxy-2-methylphenyl)-3,4-dimethylbenzenesulfonamide
CID 22202548
4-methoxy-N-(6-oxo-1H-pyridin-3-yl)benzenesulfonamide
CID 110724957
N-(4-chloro-2-methylphenyl)-4-methoxybenzenesulfonamide
CID 4995778
N-(4-methoxy-2-methylphenyl)methanesulfonamide
CID 15851883
4-methoxy-N-(5-methoxy-2-methylphenyl)benzenesulfonamide
CID 4564561
N-(4-methoxy-2-methylphenyl)-2-methylbenzenesulfonamide
CID 62997670
N-(4-methoxy-2-methylphenyl)-2-(methylamino)benzenesulfonamide
CID 62871193
N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 61249722
methyl 4-[(4-methoxyphenyl)sulfonylamino]-3-methylbenzoate
CID 36525556
N-(4-methoxy-2-methylphenyl)-1H-pyrazole-5-sulfonamide
CID 102692966
N-(4-methoxy-2-methylphenyl)-1-oxo-2,3,4,5-tetrahydropyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
CID 53182833

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide (CID 62873560) is N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide is COc1ccc(NS(=O)(=O)c2ccc(=O)[nH]c2)c(C)c1.
What is the InChIKey of N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is IMKOZEDVMXLYLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4S/c1-9-7-10(19-2)3-5-12(9)15-20(17,18)11-4-6-13(16)14-8-11/h3-8,15H,1-2H3,(H,14,16).
What are the key properties of N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide?
N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 294.33 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 62873560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).