3-ethyl-1,3-thiazolidine 1-oxide

C5H11NOS — CID 88976067

IUPAC3-ethyl-1,3-thiazolidine 1-oxide
SMILESCCN1CCS(=O)C1
InChIInChI=1S/C5H11NOS/c1-2-6-3-4-8(7)5-6/h2-5H2,1H3
InChIKeyXKAGRMZUVNMRMD-UHFFFAOYSA-N
MW133.22 g/mol
LogP0.03
Rot. Bonds1

About 3-ethyl-1,3-thiazolidine 1-oxide

3-ethyl-1,3-thiazolidine 1-oxide (PubChem CID 88976067) has the molecular formula C5H11NOS and a molecular weight of 133.22 g/mol. Its IUPAC name is 3-ethyl-1,3-thiazolidine 1-oxide.

Molecular Properties

Compound Name3-ethyl-1,3-thiazolidine 1-oxide
PubChem CID88976067
Molecular FormulaC5H11NOS
Molecular Weight133.22 g/mol
Exact Mass133.06
IUPAC Name3-ethyl-1,3-thiazolidine 1-oxide
SMILESCCN1CCS(=O)C1
InChIInChI=1S/C5H11NOS/c1-2-6-3-4-8(7)5-6/h2-5H2,1H3
InChIKeyXKAGRMZUVNMRMD-UHFFFAOYSA-N
XLogP0.03
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.22
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-1,3-thiazolidine 1-oxide 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 3-ethyl-1,3-thiazolidine 1-oxide?
The IUPAC name of 3-ethyl-1,3-thiazolidine 1-oxide (CID 88976067) is 3-ethyl-1,3-thiazolidine 1-oxide.
What is the SMILES notation for 3-ethyl-1,3-thiazolidine 1-oxide?
The canonical SMILES for 3-ethyl-1,3-thiazolidine 1-oxide is CCN1CCS(=O)C1.
What is the InChIKey of 3-ethyl-1,3-thiazolidine 1-oxide?
The InChIKey is XKAGRMZUVNMRMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NOS/c1-2-6-3-4-8(7)5-6/h2-5H2,1H3.
What are the key properties of 3-ethyl-1,3-thiazolidine 1-oxide?
3-ethyl-1,3-thiazolidine 1-oxide has a molecular weight of 133.22 g/mol, XLogP of 0.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1,3-thiazolidine 1-oxide is sourced from PubChem (CID 88976067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).