3,4-dimethyl-1,3-thiazolidine 1,1-dioxide

C5H11NO2S — CID 23520962

IUPAC3,4-dimethyl-1,3-thiazolidine 1,1-dioxide
SMILESCC1CS(=O)(=O)CN1C
InChIInChI=1S/C5H11NO2S/c1-5-3-9(7,8)4-6(5)2/h5H,3-4H2,1-2H3
InChIKeyVZHQSAPDOFCTKH-UHFFFAOYSA-N
MW149.22 g/mol
LogP-0.31
Rot. Bonds

About 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide

3,4-dimethyl-1,3-thiazolidine 1,1-dioxide (PubChem CID 23520962) has the molecular formula C5H11NO2S and a molecular weight of 149.22 g/mol. Its IUPAC name is 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide.

Molecular Properties

Compound Name3,4-dimethyl-1,3-thiazolidine 1,1-dioxide
PubChem CID23520962
Molecular FormulaC5H11NO2S
Molecular Weight149.22 g/mol
Exact Mass149.05
IUPAC Name3,4-dimethyl-1,3-thiazolidine 1,1-dioxide
SMILESCC1CS(=O)(=O)CN1C
InChIInChI=1S/C5H11NO2S/c1-5-3-9(7,8)4-6(5)2/h5H,3-4H2,1-2H3
InChIKeyVZHQSAPDOFCTKH-UHFFFAOYSA-N
XLogP-0.31
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.22
LogP ≤ 5-0.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide 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 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide?
The IUPAC name of 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide (CID 23520962) is 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide.
What is the SMILES notation for 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide?
The canonical SMILES for 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide is CC1CS(=O)(=O)CN1C.
What is the InChIKey of 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide?
The InChIKey is VZHQSAPDOFCTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2S/c1-5-3-9(7,8)4-6(5)2/h5H,3-4H2,1-2H3.
What are the key properties of 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide?
3,4-dimethyl-1,3-thiazolidine 1,1-dioxide has a molecular weight of 149.22 g/mol, XLogP of -0.31, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-1,3-thiazolidine 1,1-dioxide is sourced from PubChem (CID 23520962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).