4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide

C13H14N2O2S — CID 731623

IUPAC4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NCc2ccccn2)cc1
InChIInChI=1S/C13H14N2O2S/c1-11-5-7-13(8-6-11)18(16,17)15-10-12-4-2-3-9-14-12/h2-9,15H,10H2,1H3
InChIKeyUVXVYQURGLFLAJ-UHFFFAOYSA-N
MW262.33 g/mol
LogP1.87
Rot. Bonds4

About 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide

4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide (PubChem CID 731623) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
PubChem CID731623
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NCc2ccccn2)cc1
InChIInChI=1S/C13H14N2O2S/c1-11-5-7-13(8-6-11)18(16,17)15-10-12-4-2-3-9-14-12/h2-9,15H,10H2,1H3
InChIKeyUVXVYQURGLFLAJ-UHFFFAOYSA-N
XLogP1.87
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-methylphenyl)-4-(pyridin-2-ylmethylsulfamoyl)benzamide
CID 109060879
4-amino-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 3663787
4-(2-aminophenyl)-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 110454351
6-(methylamino)-N-(pyridin-2-ylmethyl)pyridine-3-sulfonamide
CID 62144545
4-(4-ethoxyphenoxy)-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 51169949
3-amino-4-ethyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 43257796
6-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-sulfonamide
CID 29267504
4-methyl-N-(quinoxalin-2-ylmethyl)benzenesulfonamide
CID 110869626
4-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzenesulfonamide
CID 113012724
3-amino-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 16795667
2-(4-methylphenyl)sulfonyl-N-(pyridin-2-ylmethyl)acetamide
CID 17309406
2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide
CID 2973231

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide?
The IUPAC name of 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide (CID 731623) is 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide?
The canonical SMILES for 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide is Cc1ccc(S(=O)(=O)NCc2ccccn2)cc1.
What is the InChIKey of 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide?
The InChIKey is UVXVYQURGLFLAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-11-5-7-13(8-6-11)18(16,17)15-10-12-4-2-3-9-14-12/h2-9,15H,10H2,1H3.
What are the key properties of 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide?
4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide has a molecular weight of 262.33 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 731623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).