3,5-dimethyl-1,3-thiazolidine-2-thione

C5H9NS2 — CID 14289428

IUPAC3,5-dimethyl-1,3-thiazolidine-2-thione
SMILESCC1CN(C)C(=S)S1
InChIInChI=1S/C5H9NS2/c1-4-3-6(2)5(7)8-4/h4H,3H2,1-2H3
InChIKeyZHDIXULDSSXTGE-UHFFFAOYSA-N
MW147.27 g/mol
LogP1.34
Rot. Bonds

About 3,5-dimethyl-1,3-thiazolidine-2-thione

3,5-dimethyl-1,3-thiazolidine-2-thione (PubChem CID 14289428) has the molecular formula C5H9NS2 and a molecular weight of 147.27 g/mol. Its IUPAC name is 3,5-dimethyl-1,3-thiazolidine-2-thione.

Molecular Properties

Compound Name3,5-dimethyl-1,3-thiazolidine-2-thione
PubChem CID14289428
Molecular FormulaC5H9NS2
Molecular Weight147.27 g/mol
Exact Mass147.02
IUPAC Name3,5-dimethyl-1,3-thiazolidine-2-thione
SMILESCC1CN(C)C(=S)S1
InChIInChI=1S/C5H9NS2/c1-4-3-6(2)5(7)8-4/h4H,3H2,1-2H3
InChIKeyZHDIXULDSSXTGE-UHFFFAOYSA-N
XLogP1.34
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.27
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 3,5-dimethyl-1,3-thiazolidine-2-thione 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 3,5-dimethyl-1,3-thiazolidine-2-thione?
The IUPAC name of 3,5-dimethyl-1,3-thiazolidine-2-thione (CID 14289428) is 3,5-dimethyl-1,3-thiazolidine-2-thione.
What is the SMILES notation for 3,5-dimethyl-1,3-thiazolidine-2-thione?
The canonical SMILES for 3,5-dimethyl-1,3-thiazolidine-2-thione is CC1CN(C)C(=S)S1.
What is the InChIKey of 3,5-dimethyl-1,3-thiazolidine-2-thione?
The InChIKey is ZHDIXULDSSXTGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NS2/c1-4-3-6(2)5(7)8-4/h4H,3H2,1-2H3.
What are the key properties of 3,5-dimethyl-1,3-thiazolidine-2-thione?
3,5-dimethyl-1,3-thiazolidine-2-thione has a molecular weight of 147.27 g/mol, XLogP of 1.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1,3-thiazolidine-2-thione is sourced from PubChem (CID 14289428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).