1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol

C15H16OS — CID 57276129

IUPAC1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol
SMILESOC(Cc1ccccc1)(c1cccs1)C1CC1
InChIInChI=1S/C15H16OS/c16-15(13-8-9-13,14-7-4-10-17-14)11-12-5-2-1-3-6-12/h1-7,10,13,16H,8-9,11H2
InChIKeyYGBPEIWCFUXPJW-UHFFFAOYSA-N
MW244.36 g/mol
LogP3.59
Rot. Bonds4

About 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol

1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol (PubChem CID 57276129) has the molecular formula C15H16OS and a molecular weight of 244.36 g/mol. Its IUPAC name is 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol
PubChem CID57276129
Molecular FormulaC15H16OS
Molecular Weight244.36 g/mol
Exact Mass244.09
IUPAC Name1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol
SMILESOC(Cc1ccccc1)(c1cccs1)C1CC1
InChIInChI=1S/C15H16OS/c16-15(13-8-9-13,14-7-4-10-17-14)11-12-5-2-1-3-6-12/h1-7,10,13,16H,8-9,11H2
InChIKeyYGBPEIWCFUXPJW-UHFFFAOYSA-N
XLogP3.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol 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 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol?
The IUPAC name of 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol (CID 57276129) is 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol.
What is the SMILES notation for 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol?
The canonical SMILES for 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol is OC(Cc1ccccc1)(c1cccs1)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol?
The InChIKey is YGBPEIWCFUXPJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16OS/c16-15(13-8-9-13,14-7-4-10-17-14)11-12-5-2-1-3-6-12/h1-7,10,13,16H,8-9,11H2.
What are the key properties of 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol?
1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol has a molecular weight of 244.36 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-phenyl-1-thiophen-2-ylethanol is sourced from PubChem (CID 57276129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).