3-methyl-1,3-thiazolidine

C4H9NS — CID 568508

IUPAC3-methyl-1,3-thiazolidine
SMILESCN1CCSC1
InChIInChI=1S/C4H9NS/c1-5-2-3-6-4-5/h2-4H2,1H3
InChIKeyDGYVIUKQSWPZCL-UHFFFAOYSA-N
MW103.19 g/mol
LogP0.62
Rot. Bonds

About 3-methyl-1,3-thiazolidine

3-methyl-1,3-thiazolidine (PubChem CID 568508) has the molecular formula C4H9NS and a molecular weight of 103.19 g/mol. Its IUPAC name is 3-methyl-1,3-thiazolidine.

Molecular Properties

Compound Name3-methyl-1,3-thiazolidine
PubChem CID568508
Molecular FormulaC4H9NS
Molecular Weight103.19 g/mol
Exact Mass103.05
IUPAC Name3-methyl-1,3-thiazolidine
SMILESCN1CCSC1
InChIInChI=1S/C4H9NS/c1-5-2-3-6-4-5/h2-4H2,1H3
InChIKeyDGYVIUKQSWPZCL-UHFFFAOYSA-N
XLogP0.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.19
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,3-thiazolidine?
The IUPAC name of 3-methyl-1,3-thiazolidine (CID 568508) is 3-methyl-1,3-thiazolidine.
What is the SMILES notation for 3-methyl-1,3-thiazolidine?
The canonical SMILES for 3-methyl-1,3-thiazolidine is CN1CCSC1.
What is the InChIKey of 3-methyl-1,3-thiazolidine?
The InChIKey is DGYVIUKQSWPZCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NS/c1-5-2-3-6-4-5/h2-4H2,1H3.
What are the key properties of 3-methyl-1,3-thiazolidine?
3-methyl-1,3-thiazolidine has a molecular weight of 103.19 g/mol, XLogP of 0.62, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,3-thiazolidine is sourced from PubChem (CID 568508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).