(2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide

C11H17ClN2O3S2 — CID 97221791

IUPAC(2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide
SMILESCCNS(=O)(=O)CCNC(=O)[C@H](C)c1ccc(Cl)s1
InChIInChI=1S/C11H17ClN2O3S2/c1-3-14-19(16,17)7-6-13-11(15)8(2)9-4-5-10(12)18-9/h4-5,8,14H,3,6-7H2,1-2H3,(H,13,15)/t8-/m1/s1
InChIKeyZDVNSQCBOFSLDK-MRVPVSSYSA-N
MW324.86 g/mol
LogP1.56
Rot. Bonds7

About (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide

(2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide (PubChem CID 97221791) has the molecular formula C11H17ClN2O3S2 and a molecular weight of 324.86 g/mol. Its IUPAC name is (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide.

Molecular Properties

Compound Name(2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide
PubChem CID97221791
Molecular FormulaC11H17ClN2O3S2
Molecular Weight324.86 g/mol
Exact Mass324.04
IUPAC Name(2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide
SMILESCCNS(=O)(=O)CCNC(=O)[C@H](C)c1ccc(Cl)s1
InChIInChI=1S/C11H17ClN2O3S2/c1-3-14-19(16,17)7-6-13-11(15)8(2)9-4-5-10(12)18-9/h4-5,8,14H,3,6-7H2,1-2H3,(H,13,15)/t8-/m1/s1
InChIKeyZDVNSQCBOFSLDK-MRVPVSSYSA-N
XLogP1.56
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.86
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide 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 (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide?
The IUPAC name of (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide (CID 97221791) is (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide.
What is the SMILES notation for (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide?
The canonical SMILES for (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide is CCNS(=O)(=O)CCNC(=O)[C@H](C)c1ccc(Cl)s1.
What is the InChIKey of (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide?
The InChIKey is ZDVNSQCBOFSLDK-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H17ClN2O3S2/c1-3-14-19(16,17)7-6-13-11(15)8(2)9-4-5-10(12)18-9/h4-5,8,14H,3,6-7H2,1-2H3,(H,13,15)/t8-/m1/s1.
What are the key properties of (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide?
(2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide has a molecular weight of 324.86 g/mol, XLogP of 1.56, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(5-chlorothiophen-2-yl)-N-[2-(ethylsulfamoyl)ethyl]propanamide is sourced from PubChem (CID 97221791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).