4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide

C15H23ClN2O2S — CID 874478

IUPAC4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide
SMILESCC1(C)CC(NS(=O)(=O)c2ccc(Cl)cc2)CC(C)(C)N1
InChIInChI=1S/C15H23ClN2O2S/c1-14(2)9-12(10-15(3,4)18-14)17-21(19,20)13-7-5-11(16)6-8-13/h5-8,12,17-18H,9-10H2,1-4H3
InChIKeyKNJKZLPXGQJFLE-UHFFFAOYSA-N
MW330.88 g/mol
LogP2.93
Rot. Bonds3

About 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide

4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide (PubChem CID 874478) has the molecular formula C15H23ClN2O2S and a molecular weight of 330.88 g/mol. Its IUPAC name is 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide
PubChem CID874478
Molecular FormulaC15H23ClN2O2S
Molecular Weight330.88 g/mol
Exact Mass330.12
IUPAC Name4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide
SMILESCC1(C)CC(NS(=O)(=O)c2ccc(Cl)cc2)CC(C)(C)N1
InChIInChI=1S/C15H23ClN2O2S/c1-14(2)9-12(10-15(3,4)18-14)17-21(19,20)13-7-5-11(16)6-8-13/h5-8,12,17-18H,9-10H2,1-4H3
InChIKeyKNJKZLPXGQJFLE-UHFFFAOYSA-N
XLogP2.93
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.88
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide?
The IUPAC name of 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide (CID 874478) is 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide.
What is the SMILES notation for 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide?
The canonical SMILES for 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide is CC1(C)CC(NS(=O)(=O)c2ccc(Cl)cc2)CC(C)(C)N1.
What is the InChIKey of 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide?
The InChIKey is KNJKZLPXGQJFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2O2S/c1-14(2)9-12(10-15(3,4)18-14)17-21(19,20)13-7-5-11(16)6-8-13/h5-8,12,17-18H,9-10H2,1-4H3.
What are the key properties of 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide?
4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide has a molecular weight of 330.88 g/mol, XLogP of 2.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide is sourced from PubChem (CID 874478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).