(5S)-5-fluoro-3-methyl-1,3-thiazolidine

C4H8FNS — CID 166798904

IUPAC(5S)-5-fluoro-3-methyl-1,3-thiazolidine
SMILESCN1CS[C@H](F)C1
InChIInChI=1S/C4H8FNS/c1-6-2-4(5)7-3-6/h4H,2-3H2,1H3/t4-/m0/s1
InChIKeyGSNZJYGAWZWRRE-BYPYZUCNSA-N
MW121.18 g/mol
LogP0.92
Rot. Bonds

About (5S)-5-fluoro-3-methyl-1,3-thiazolidine

(5S)-5-fluoro-3-methyl-1,3-thiazolidine (PubChem CID 166798904) has the molecular formula C4H8FNS and a molecular weight of 121.18 g/mol. Its IUPAC name is (5S)-5-fluoro-3-methyl-1,3-thiazolidine.

Molecular Properties

Compound Name(5S)-5-fluoro-3-methyl-1,3-thiazolidine
PubChem CID166798904
Molecular FormulaC4H8FNS
Molecular Weight121.18 g/mol
Exact Mass121.04
IUPAC Name(5S)-5-fluoro-3-methyl-1,3-thiazolidine
SMILESCN1CS[C@H](F)C1
InChIInChI=1S/C4H8FNS/c1-6-2-4(5)7-3-6/h4H,2-3H2,1H3/t4-/m0/s1
InChIKeyGSNZJYGAWZWRRE-BYPYZUCNSA-N
XLogP0.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.18
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-fluoro-3-methyl-1,3-thiazolidine?
The IUPAC name of (5S)-5-fluoro-3-methyl-1,3-thiazolidine (CID 166798904) is (5S)-5-fluoro-3-methyl-1,3-thiazolidine.
What is the SMILES notation for (5S)-5-fluoro-3-methyl-1,3-thiazolidine?
The canonical SMILES for (5S)-5-fluoro-3-methyl-1,3-thiazolidine is CN1CS[C@H](F)C1.
What is the InChIKey of (5S)-5-fluoro-3-methyl-1,3-thiazolidine?
The InChIKey is GSNZJYGAWZWRRE-BYPYZUCNSA-N. The full InChI is InChI=1S/C4H8FNS/c1-6-2-4(5)7-3-6/h4H,2-3H2,1H3/t4-/m0/s1.
What are the key properties of (5S)-5-fluoro-3-methyl-1,3-thiazolidine?
(5S)-5-fluoro-3-methyl-1,3-thiazolidine has a molecular weight of 121.18 g/mol, XLogP of 0.92, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-fluoro-3-methyl-1,3-thiazolidine is sourced from PubChem (CID 166798904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).