5,5-difluoro-3-methyl-1,3-thiazolidine

C4H7F2NS — CID 166799239

IUPAC5,5-difluoro-3-methyl-1,3-thiazolidine
SMILESCN1CSC(F)(F)C1
InChIInChI=1S/C4H7F2NS/c1-7-2-4(5,6)8-3-7/h2-3H2,1H3
InChIKeyFMAAGEGDMOTRQA-UHFFFAOYSA-N
MW139.17 g/mol
LogP1.22
Rot. Bonds

About 5,5-difluoro-3-methyl-1,3-thiazolidine

5,5-difluoro-3-methyl-1,3-thiazolidine (PubChem CID 166799239) has the molecular formula C4H7F2NS and a molecular weight of 139.17 g/mol. Its IUPAC name is 5,5-difluoro-3-methyl-1,3-thiazolidine.

Molecular Properties

Compound Name5,5-difluoro-3-methyl-1,3-thiazolidine
PubChem CID166799239
Molecular FormulaC4H7F2NS
Molecular Weight139.17 g/mol
Exact Mass139.03
IUPAC Name5,5-difluoro-3-methyl-1,3-thiazolidine
SMILESCN1CSC(F)(F)C1
InChIInChI=1S/C4H7F2NS/c1-7-2-4(5,6)8-3-7/h2-3H2,1H3
InChIKeyFMAAGEGDMOTRQA-UHFFFAOYSA-N
XLogP1.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.17
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,5-difluoro-3-methyl-1,3-thiazolidine?
The IUPAC name of 5,5-difluoro-3-methyl-1,3-thiazolidine (CID 166799239) is 5,5-difluoro-3-methyl-1,3-thiazolidine.
What is the SMILES notation for 5,5-difluoro-3-methyl-1,3-thiazolidine?
The canonical SMILES for 5,5-difluoro-3-methyl-1,3-thiazolidine is CN1CSC(F)(F)C1.
What is the InChIKey of 5,5-difluoro-3-methyl-1,3-thiazolidine?
The InChIKey is FMAAGEGDMOTRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7F2NS/c1-7-2-4(5,6)8-3-7/h2-3H2,1H3.
What are the key properties of 5,5-difluoro-3-methyl-1,3-thiazolidine?
5,5-difluoro-3-methyl-1,3-thiazolidine has a molecular weight of 139.17 g/mol, XLogP of 1.22, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-difluoro-3-methyl-1,3-thiazolidine is sourced from PubChem (CID 166799239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).