2-(2-methylsulfinylphenyl)propan-2-ol

C10H14O2S — CID 15373524

IUPAC2-(2-methylsulfinylphenyl)propan-2-ol
SMILESCS(=O)c1ccccc1C(C)(C)O
InChIInChI=1S/C10H14O2S/c1-10(2,11)8-6-4-5-7-9(8)13(3)12/h4-7,11H,1-3H3
InChIKeyFSGWFDFFKCAFHV-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.65
Rot. Bonds2

About 2-(2-methylsulfinylphenyl)propan-2-ol

2-(2-methylsulfinylphenyl)propan-2-ol (PubChem CID 15373524) has the molecular formula C10H14O2S and a molecular weight of 198.29 g/mol. Its IUPAC name is 2-(2-methylsulfinylphenyl)propan-2-ol.

Molecular Properties

Compound Name2-(2-methylsulfinylphenyl)propan-2-ol
PubChem CID15373524
Molecular FormulaC10H14O2S
Molecular Weight198.29 g/mol
Exact Mass198.07
IUPAC Name2-(2-methylsulfinylphenyl)propan-2-ol
SMILESCS(=O)c1ccccc1C(C)(C)O
InChIInChI=1S/C10H14O2S/c1-10(2,11)8-6-4-5-7-9(8)13(3)12/h4-7,11H,1-3H3
InChIKeyFSGWFDFFKCAFHV-UHFFFAOYSA-N
XLogP1.65
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-methylsulfinylphenyl)propan-2-ol 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 2-(2-methylsulfinylphenyl)propan-2-ol?
The IUPAC name of 2-(2-methylsulfinylphenyl)propan-2-ol (CID 15373524) is 2-(2-methylsulfinylphenyl)propan-2-ol.
What is the SMILES notation for 2-(2-methylsulfinylphenyl)propan-2-ol?
The canonical SMILES for 2-(2-methylsulfinylphenyl)propan-2-ol is CS(=O)c1ccccc1C(C)(C)O.
What is the InChIKey of 2-(2-methylsulfinylphenyl)propan-2-ol?
The InChIKey is FSGWFDFFKCAFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2S/c1-10(2,11)8-6-4-5-7-9(8)13(3)12/h4-7,11H,1-3H3.
What are the key properties of 2-(2-methylsulfinylphenyl)propan-2-ol?
2-(2-methylsulfinylphenyl)propan-2-ol has a molecular weight of 198.29 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylsulfinylphenyl)propan-2-ol is sourced from PubChem (CID 15373524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).