N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide

C14H16N2O3S3 — CID 2178062

IUPACN-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)CSc2cccs2)cc1
InChIInChI=1S/C14H16N2O3S3/c15-22(18,19)12-5-3-11(4-6-12)7-8-16-13(17)10-21-14-2-1-9-20-14/h1-6,9H,7-8,10H2,(H,16,17)(H2,15,18,19)
InChIKeyRFTIXIMKXXBTQT-UHFFFAOYSA-N
MW356.49 g/mol
LogP1.85
Rot. Bonds7

About N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide

N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide (PubChem CID 2178062) has the molecular formula C14H16N2O3S3 and a molecular weight of 356.49 g/mol. Its IUPAC name is N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide
PubChem CID2178062
Molecular FormulaC14H16N2O3S3
Molecular Weight356.49 g/mol
Exact Mass356.03
IUPAC NameN-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)CSc2cccs2)cc1
InChIInChI=1S/C14H16N2O3S3/c15-22(18,19)12-5-3-11(4-6-12)7-8-16-13(17)10-21-14-2-1-9-20-14/h1-6,9H,7-8,10H2,(H,16,17)(H2,15,18,19)
InChIKeyRFTIXIMKXXBTQT-UHFFFAOYSA-N
XLogP1.85
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.49
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide 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 N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide?
The IUPAC name of N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide (CID 2178062) is N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide.
What is the SMILES notation for N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide?
The canonical SMILES for N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide is NS(=O)(=O)c1ccc(CCNC(=O)CSc2cccs2)cc1.
What is the InChIKey of N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide?
The InChIKey is RFTIXIMKXXBTQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S3/c15-22(18,19)12-5-3-11(4-6-12)7-8-16-13(17)10-21-14-2-1-9-20-14/h1-6,9H,7-8,10H2,(H,16,17)(H2,15,18,19).
What are the key properties of N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide?
N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide has a molecular weight of 356.49 g/mol, XLogP of 1.85, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylsulfanylacetamide is sourced from PubChem (CID 2178062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).