4-ethyl-2-thiophen-3-yl-1,3-thiazolidine

C9H13NS2 — CID 66228650

IUPAC4-ethyl-2-thiophen-3-yl-1,3-thiazolidine
SMILESCCC1CSC(c2ccsc2)N1
InChIInChI=1S/C9H13NS2/c1-2-8-6-12-9(10-8)7-3-4-11-5-7/h3-5,8-10H,2,6H2,1H3
InChIKeyDXAOJEBYUCIXND-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.86
Rot. Bonds2

About 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine

4-ethyl-2-thiophen-3-yl-1,3-thiazolidine (PubChem CID 66228650) has the molecular formula C9H13NS2 and a molecular weight of 199.34 g/mol. Its IUPAC name is 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine.

Molecular Properties

Compound Name4-ethyl-2-thiophen-3-yl-1,3-thiazolidine
PubChem CID66228650
Molecular FormulaC9H13NS2
Molecular Weight199.34 g/mol
Exact Mass199.05
IUPAC Name4-ethyl-2-thiophen-3-yl-1,3-thiazolidine
SMILESCCC1CSC(c2ccsc2)N1
InChIInChI=1S/C9H13NS2/c1-2-8-6-12-9(10-8)7-3-4-11-5-7/h3-5,8-10H,2,6H2,1H3
InChIKeyDXAOJEBYUCIXND-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine 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-ethyl-2-thiophen-3-yl-1,3-thiazolidine?
The IUPAC name of 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine (CID 66228650) is 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine.
What is the SMILES notation for 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine?
The canonical SMILES for 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine is CCC1CSC(c2ccsc2)N1.
What is the InChIKey of 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine?
The InChIKey is DXAOJEBYUCIXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NS2/c1-2-8-6-12-9(10-8)7-3-4-11-5-7/h3-5,8-10H,2,6H2,1H3.
What are the key properties of 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine?
4-ethyl-2-thiophen-3-yl-1,3-thiazolidine has a molecular weight of 199.34 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-thiophen-3-yl-1,3-thiazolidine is sourced from PubChem (CID 66228650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).