2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide

C14H15ClN2O2S — CID 32673521

IUPAC2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NCCc2ccccn2)c(Cl)c1
InChIInChI=1S/C14H15ClN2O2S/c1-11-5-6-14(13(15)10-11)20(18,19)17-9-7-12-4-2-3-8-16-12/h2-6,8,10,17H,7,9H2,1H3
InChIKeyQEGXVLGUYUDGKG-UHFFFAOYSA-N
MW310.81 g/mol
LogP2.56
Rot. Bonds5

About 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide

2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide (PubChem CID 32673521) has the molecular formula C14H15ClN2O2S and a molecular weight of 310.81 g/mol. Its IUPAC name is 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide
PubChem CID32673521
Molecular FormulaC14H15ClN2O2S
Molecular Weight310.81 g/mol
Exact Mass310.05
IUPAC Name2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NCCc2ccccn2)c(Cl)c1
InChIInChI=1S/C14H15ClN2O2S/c1-11-5-6-14(13(15)10-11)20(18,19)17-9-7-12-4-2-3-8-16-12/h2-6,8,10,17H,7,9H2,1H3
InChIKeyQEGXVLGUYUDGKG-UHFFFAOYSA-N
XLogP2.56
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.81
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)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

2,3-dichloro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 47104213
2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide
CID 4657628
4-bromo-2-fluoro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 116528063
8-methyl-N-(2-pyridin-2-ylethyl)quinoline-5-sulfonamide
CID 134034355
3,5-dichloro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 3799880
2-hydroxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 81241460
5-bromo-2-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 25048330
N-(3-aminobutyl)-2-chloro-4-methylbenzenesulfonamide
CID 63253709
6-amino-5-chloro-N-(2-pyridin-2-ylethyl)pyridine-3-sulfonamide
CID 64607542
5-methyl-4-(2-pyridin-2-ylethylsulfamoyl)furan-2-carboxylic acid
CID 62803786
2-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-1-(2-pyridin-2-ylethyl)guanidine;hydroiodide
CID 111043857
5-chloro-6-oxo-N-(2-pyridin-2-ylethyl)-1H-pyridine-3-sulfonamide
CID 64609007

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide?
The IUPAC name of 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide (CID 32673521) is 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide.
What is the SMILES notation for 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide?
The canonical SMILES for 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide is Cc1ccc(S(=O)(=O)NCCc2ccccn2)c(Cl)c1.
What is the InChIKey of 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide?
The InChIKey is QEGXVLGUYUDGKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2S/c1-11-5-6-14(13(15)10-11)20(18,19)17-9-7-12-4-2-3-8-16-12/h2-6,8,10,17H,7,9H2,1H3.
What are the key properties of 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide?
2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide has a molecular weight of 310.81 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide is sourced from PubChem (CID 32673521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).