3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol

C10H14OS — CID 103564638

IUPAC3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol
SMILESCc1cc(C2(O)CC(C)C2)cs1
InChIInChI=1S/C10H14OS/c1-7-4-10(11,5-7)9-3-8(2)12-6-9/h3,6-7,11H,4-5H2,1-2H3
InChIKeyQJXUCISAQZLHLI-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.67
Rot. Bonds1

About 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol

3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol (PubChem CID 103564638) has the molecular formula C10H14OS and a molecular weight of 182.29 g/mol. Its IUPAC name is 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol
PubChem CID103564638
Molecular FormulaC10H14OS
Molecular Weight182.29 g/mol
Exact Mass182.08
IUPAC Name3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol
SMILESCc1cc(C2(O)CC(C)C2)cs1
InChIInChI=1S/C10H14OS/c1-7-4-10(11,5-7)9-3-8(2)12-6-9/h3,6-7,11H,4-5H2,1-2H3
InChIKeyQJXUCISAQZLHLI-UHFFFAOYSA-N
XLogP2.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-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 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol?
The IUPAC name of 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol (CID 103564638) is 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol.
What is the SMILES notation for 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol?
The canonical SMILES for 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol is Cc1cc(C2(O)CC(C)C2)cs1.
What is the InChIKey of 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol?
The InChIKey is QJXUCISAQZLHLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14OS/c1-7-4-10(11,5-7)9-3-8(2)12-6-9/h3,6-7,11H,4-5H2,1-2H3.
What are the key properties of 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol?
3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol has a molecular weight of 182.29 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(5-methylthiophen-3-yl)cyclobutan-1-ol is sourced from PubChem (CID 103564638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).