N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide

C14H14ClNO3S — CID 47310702

IUPACN-(5-chloro-2-ethoxyphenyl)benzenesulfonamide
SMILESCCOc1ccc(Cl)cc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C14H14ClNO3S/c1-2-19-14-9-8-11(15)10-13(14)16-20(17,18)12-6-4-3-5-7-12/h3-10,16H,2H2,1H3
InChIKeyJHUBAZYZZLNWEN-UHFFFAOYSA-N
MW311.79 g/mol
LogP3.54
Rot. Bonds5

About N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide

N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide (PubChem CID 47310702) has the molecular formula C14H14ClNO3S and a molecular weight of 311.79 g/mol. Its IUPAC name is N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2-ethoxyphenyl)benzenesulfonamide
PubChem CID47310702
Molecular FormulaC14H14ClNO3S
Molecular Weight311.79 g/mol
Exact Mass311.04
IUPAC NameN-(5-chloro-2-ethoxyphenyl)benzenesulfonamide
SMILESCCOc1ccc(Cl)cc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C14H14ClNO3S/c1-2-19-14-9-8-11(15)10-13(14)16-20(17,18)12-6-4-3-5-7-12/h3-10,16H,2H2,1H3
InChIKeyJHUBAZYZZLNWEN-UHFFFAOYSA-N
XLogP3.54
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.79
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(5-chloro-2-ethoxyphenyl)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

3-bromo-N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide
CID 63422726
N-(5-chloro-2-ethoxyphenyl)-1H-pyrazole-4-sulfonamide
CID 47267974
N-(5-chloro-2-methoxyphenyl)-3,4-diethoxybenzenesulfonamide
CID 9172723
[2-(benzenesulfonamido)-4-chlorophenyl] acetate
CID 51700783
N-(5-chloro-2-ethoxyphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299319
N-(5-chloro-2-methoxyphenyl)-4-ethoxy-3-propan-2-ylbenzenesulfonamide
CID 6456783
N-[5-chloro-2-(dimethylamino)phenyl]-3,4-diethoxybenzenesulfonamide
CID 9030613
N-[4-chloro-2-(methanesulfonamido)phenyl]benzenesulfonamide
CID 134879213
N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide
CID 155537500
4-[(5-chloro-2-ethoxyphenyl)sulfamoyl]butanoic acid
CID 60933027
4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
CID 7559506
3-chloro-4-ethoxy-N-phenylbenzenesulfonamide
CID 110758153

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide?
The IUPAC name of N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide (CID 47310702) is N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide.
What is the SMILES notation for N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide?
The canonical SMILES for N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide is CCOc1ccc(Cl)cc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide?
The InChIKey is JHUBAZYZZLNWEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO3S/c1-2-19-14-9-8-11(15)10-13(14)16-20(17,18)12-6-4-3-5-7-12/h3-10,16H,2H2,1H3.
What are the key properties of N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide?
N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide has a molecular weight of 311.79 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 47310702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).