[(3S)-thiolan-3-yl]methanol

C5H10OS — CID 89040565

IUPAC[(3S)-thiolan-3-yl]methanol
SMILESOC[C@@H]1CCSC1
InChIInChI=1S/C5H10OS/c6-3-5-1-2-7-4-5/h5-6H,1-4H2/t5-/m0/s1
InChIKeyIJZYALNIAFIXNC-YFKPBYRVSA-N
MW118.20 g/mol
LogP0.73
Rot. Bonds1

About [(3S)-thiolan-3-yl]methanol

[(3S)-thiolan-3-yl]methanol (PubChem CID 89040565) has the molecular formula C5H10OS and a molecular weight of 118.20 g/mol. Its IUPAC name is [(3S)-thiolan-3-yl]methanol.

Molecular Properties

Compound Name[(3S)-thiolan-3-yl]methanol
PubChem CID89040565
Molecular FormulaC5H10OS
Molecular Weight118.20 g/mol
Exact Mass118.05
IUPAC Name[(3S)-thiolan-3-yl]methanol
SMILESOC[C@@H]1CCSC1
InChIInChI=1S/C5H10OS/c6-3-5-1-2-7-4-5/h5-6H,1-4H2/t5-/m0/s1
InChIKeyIJZYALNIAFIXNC-YFKPBYRVSA-N
XLogP0.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.20
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(3S)-thiolan-3-yl]methanol 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 [(3S)-thiolan-3-yl]methanol?
The IUPAC name of [(3S)-thiolan-3-yl]methanol (CID 89040565) is [(3S)-thiolan-3-yl]methanol.
What is the SMILES notation for [(3S)-thiolan-3-yl]methanol?
The canonical SMILES for [(3S)-thiolan-3-yl]methanol is OC[C@@H]1CCSC1.
What is the InChIKey of [(3S)-thiolan-3-yl]methanol?
The InChIKey is IJZYALNIAFIXNC-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H10OS/c6-3-5-1-2-7-4-5/h5-6H,1-4H2/t5-/m0/s1.
What are the key properties of [(3S)-thiolan-3-yl]methanol?
[(3S)-thiolan-3-yl]methanol has a molecular weight of 118.20 g/mol, XLogP of 0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-thiolan-3-yl]methanol is sourced from PubChem (CID 89040565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).