2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide

C15H17N3O2S3 — CID 2158846

IUPAC2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
SMILESO=C(CSCC(=O)N1CCCC1)Nc1nc(-c2cccs2)cs1
InChIInChI=1S/C15H17N3O2S3/c19-13(9-21-10-14(20)18-5-1-2-6-18)17-15-16-11(8-23-15)12-4-3-7-22-12/h3-4,7-8H,1-2,5-6,9-10H2,(H,16,17,19)
InChIKeyZEATZGPJUJMZTB-UHFFFAOYSA-N
MW367.52 g/mol
LogP3.17
Rot. Bonds6

About 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide

2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 2158846) has the molecular formula C15H17N3O2S3 and a molecular weight of 367.52 g/mol. Its IUPAC name is 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
PubChem CID2158846
Molecular FormulaC15H17N3O2S3
Molecular Weight367.52 g/mol
Exact Mass367.05
IUPAC Name2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
SMILESO=C(CSCC(=O)N1CCCC1)Nc1nc(-c2cccs2)cs1
InChIInChI=1S/C15H17N3O2S3/c19-13(9-21-10-14(20)18-5-1-2-6-18)17-15-16-11(8-23-15)12-4-3-7-22-12/h3-4,7-8H,1-2,5-6,9-10H2,(H,16,17,19)
InChIKeyZEATZGPJUJMZTB-UHFFFAOYSA-N
XLogP3.17
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.52
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide 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 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide (CID 2158846) is 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide is O=C(CSCC(=O)N1CCCC1)Nc1nc(-c2cccs2)cs1.
What is the InChIKey of 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide?
The InChIKey is ZEATZGPJUJMZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2S3/c19-13(9-21-10-14(20)18-5-1-2-6-18)17-15-16-11(8-23-15)12-4-3-7-22-12/h3-4,7-8H,1-2,5-6,9-10H2,(H,16,17,19).
What are the key properties of 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide?
2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 367.52 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 2158846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).