N-(2-cyanophenyl)benzenesulfonamide

C13H10N2O2S — CID 736007

IUPACN-(2-cyanophenyl)benzenesulfonamide
SMILESN#Cc1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C13H10N2O2S/c14-10-11-6-4-5-9-13(11)15-18(16,17)12-7-2-1-3-8-12/h1-9,15H
InChIKeyRVGDWOOVHPEPNQ-UHFFFAOYSA-N
MW258.30 g/mol
LogP2.36
Rot. Bonds3

About N-(2-cyanophenyl)benzenesulfonamide

N-(2-cyanophenyl)benzenesulfonamide (PubChem CID 736007) has the molecular formula C13H10N2O2S and a molecular weight of 258.30 g/mol. Its IUPAC name is N-(2-cyanophenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)benzenesulfonamide
PubChem CID736007
Molecular FormulaC13H10N2O2S
Molecular Weight258.30 g/mol
Exact Mass258.05
IUPAC NameN-(2-cyanophenyl)benzenesulfonamide
SMILESN#Cc1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C13H10N2O2S/c14-10-11-6-4-5-9-13(11)15-18(16,17)12-7-2-1-3-8-12/h1-9,15H
InChIKeyRVGDWOOVHPEPNQ-UHFFFAOYSA-N
XLogP2.36
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-cyanophenyl)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

4-[(2-cyanophenyl)sulfamoyl]-N-methyl-N-phenylbenzamide
CID 109061726
2-chloro-5-[(2-cyanophenyl)sulfamoyl]benzoic acid
CID 110757054
3-amino-N-(2-cyanophenyl)-5-fluorobenzenesulfonamide
CID 63321859
N-(2-cyanophenyl)-3,4-dimethoxybenzenesulfonamide
CID 2824579
N-(2-cyanophenyl)-1-methylpyrazole-4-sulfonamide
CID 62061919
3-amino-N-(2-cyanophenyl)-4,5-dimethylbenzenesulfonamide
CID 28522562
3-(benzenesulfonamido)-N-(2-cyanophenyl)propanamide
CID 17225888
N-(3,4-dicyanophenyl)benzenesulfonamide
CID 113220864
N-(2-cyanophenyl)-1,1-difluoromethanesulfonamide
CID 28607000
N-[5-(benzenesulfonamido)naphthalen-1-yl]benzenesulfonamide
CID 3389796
N-(2-cyanophenyl)-4-(4-formylpiperazine-1-carbonyl)benzenesulfonamide
CID 109060459
4-[(2-cyanophenyl)sulfamoyl]-N-(3-fluorophenyl)benzamide
CID 109061815

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)benzenesulfonamide?
The IUPAC name of N-(2-cyanophenyl)benzenesulfonamide (CID 736007) is N-(2-cyanophenyl)benzenesulfonamide.
What is the SMILES notation for N-(2-cyanophenyl)benzenesulfonamide?
The canonical SMILES for N-(2-cyanophenyl)benzenesulfonamide is N#Cc1ccccc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-(2-cyanophenyl)benzenesulfonamide?
The InChIKey is RVGDWOOVHPEPNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O2S/c14-10-11-6-4-5-9-13(11)15-18(16,17)12-7-2-1-3-8-12/h1-9,15H.
What are the key properties of N-(2-cyanophenyl)benzenesulfonamide?
N-(2-cyanophenyl)benzenesulfonamide has a molecular weight of 258.30 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)benzenesulfonamide is sourced from PubChem (CID 736007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).