4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide

C13H14N2O2S — CID 66524316

IUPAC4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccncc2C)cc1
InChIInChI=1S/C13H14N2O2S/c1-10-3-5-12(6-4-10)18(16,17)15-13-7-8-14-9-11(13)2/h3-9H,1-2H3,(H,14,15)
InChIKeyXFQPCNDFXCNBCK-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.50
Rot. Bonds3

About 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide

4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide (PubChem CID 66524316) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide
PubChem CID66524316
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccncc2C)cc1
InChIInChI=1S/C13H14N2O2S/c1-10-3-5-12(6-4-10)18(16,17)15-13-7-8-14-9-11(13)2/h3-9H,1-2H3,(H,14,15)
InChIKeyXFQPCNDFXCNBCK-UHFFFAOYSA-N
XLogP2.50
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(3-methyl-4-pyridinyl)benzenesulfonamide
CID 63669666
4-acetyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide
CID 63670374
N-(8-bromoisoquinolin-5-yl)-4-methylbenzenesulfonamide
CID 169372757
3-amino-5-fluoro-N-(3-methyl-4-pyridinyl)benzenesulfonamide
CID 63667962
3-[(3-methyl-4-pyridinyl)sulfamoyl]benzoic acid
CID 63672038
N-(4-methylphenyl)-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide
CID 70789421
4-[(3-methyl-4-pyridinyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid
CID 63672039
3-amino-2,5-dimethyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide
CID 79889835
4-methyl-N-(2,4,5-trimethylphenyl)benzenesulfonamide
CID 59317382
4-methyl-N-[2-[2-[(4-methylphenyl)sulfonylamino]phenyl]phenyl]benzenesulfonamide
CID 1010988
N-(3-fluoro-2,4-dimethylphenyl)-4-methylbenzenesulfonamide
CID 169372704
2,5-dibromo-4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide
CID 80708249

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide (CID 66524316) is 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide is Cc1ccc(S(=O)(=O)Nc2ccncc2C)cc1.
What is the InChIKey of 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide?
The InChIKey is XFQPCNDFXCNBCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-10-3-5-12(6-4-10)18(16,17)15-13-7-8-14-9-11(13)2/h3-9H,1-2H3,(H,14,15).
What are the key properties of 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide?
4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide has a molecular weight of 262.33 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(3-methyl-4-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 66524316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).