3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol

C10H13ClOS — CID 63357723

IUPAC3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol
SMILESOC(CCc1ccc(Cl)s1)C1CC1
InChIInChI=1S/C10H13ClOS/c11-10-6-4-8(13-10)3-5-9(12)7-1-2-7/h4,6-7,9,12H,1-3,5H2
InChIKeyWBSIQNOPPDZGKJ-UHFFFAOYSA-N
MW216.73 g/mol
LogP3.11
Rot. Bonds4

About 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol

3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol (PubChem CID 63357723) has the molecular formula C10H13ClOS and a molecular weight of 216.73 g/mol. Its IUPAC name is 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol.

Molecular Properties

Compound Name3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol
PubChem CID63357723
Molecular FormulaC10H13ClOS
Molecular Weight216.73 g/mol
Exact Mass216.04
IUPAC Name3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol
SMILESOC(CCc1ccc(Cl)s1)C1CC1
InChIInChI=1S/C10H13ClOS/c11-10-6-4-8(13-10)3-5-9(12)7-1-2-7/h4,6-7,9,12H,1-3,5H2
InChIKeyWBSIQNOPPDZGKJ-UHFFFAOYSA-N
XLogP3.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.73
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-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-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol?
The IUPAC name of 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol (CID 63357723) is 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol.
What is the SMILES notation for 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol?
The canonical SMILES for 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol is OC(CCc1ccc(Cl)s1)C1CC1.
What is the InChIKey of 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol?
The InChIKey is WBSIQNOPPDZGKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClOS/c11-10-6-4-8(13-10)3-5-9(12)7-1-2-7/h4,6-7,9,12H,1-3,5H2.
What are the key properties of 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol?
3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol has a molecular weight of 216.73 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chlorothiophen-2-yl)-1-cyclopropylpropan-1-ol is sourced from PubChem (CID 63357723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).