5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide

C15H17ClN2O4S3 — CID 4579047

IUPAC5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(Cl)s1
InChIInChI=1S/C15H17ClN2O4S3/c16-14-7-8-15(23-14)24(19,20)17-12-5-4-6-13(11-12)25(21,22)18-9-2-1-3-10-18/h4-8,11,17H,1-3,9-10H2
InChIKeyURRPUHXDGMLPFE-UHFFFAOYSA-N
MW420.97 g/mol
LogP3.38
Rot. Bonds5

About 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide

5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide (PubChem CID 4579047) has the molecular formula C15H17ClN2O4S3 and a molecular weight of 420.97 g/mol. Its IUPAC name is 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide
PubChem CID4579047
Molecular FormulaC15H17ClN2O4S3
Molecular Weight420.97 g/mol
Exact Mass420.00
IUPAC Name5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(Cl)s1
InChIInChI=1S/C15H17ClN2O4S3/c16-14-7-8-15(23-14)24(19,20)17-12-5-4-6-13(11-12)25(21,22)18-9-2-1-3-10-18/h4-8,11,17H,1-3,9-10H2
InChIKeyURRPUHXDGMLPFE-UHFFFAOYSA-N
XLogP3.38
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.97
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide 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 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide (CID 4579047) is 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide is O=S(=O)(Nc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide?
The InChIKey is URRPUHXDGMLPFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O4S3/c16-14-7-8-15(23-14)24(19,20)17-12-5-4-6-13(11-12)25(21,22)18-9-2-1-3-10-18/h4-8,11,17H,1-3,9-10H2.
What are the key properties of 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide?
5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide has a molecular weight of 420.97 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-piperidin-1-ylsulfonylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 4579047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).