4-(thiophen-2-ylmethyl)phenol

C11H10OS — CID 605440

IUPAC4-(thiophen-2-ylmethyl)phenol
SMILESOc1ccc(Cc2cccs2)cc1
InChIInChI=1S/C11H10OS/c12-10-5-3-9(4-6-10)8-11-2-1-7-13-11/h1-7,12H,8H2
InChIKeyYHOIZMRUUWRATR-UHFFFAOYSA-N
MW190.27 g/mol
LogP3.04
Rot. Bonds2

About 4-(thiophen-2-ylmethyl)phenol

4-(thiophen-2-ylmethyl)phenol (PubChem CID 605440) has the molecular formula C11H10OS and a molecular weight of 190.27 g/mol. Its IUPAC name is 4-(thiophen-2-ylmethyl)phenol.

Molecular Properties

Compound Name4-(thiophen-2-ylmethyl)phenol
PubChem CID605440
Molecular FormulaC11H10OS
Molecular Weight190.27 g/mol
Exact Mass190.05
IUPAC Name4-(thiophen-2-ylmethyl)phenol
SMILESOc1ccc(Cc2cccs2)cc1
InChIInChI=1S/C11H10OS/c12-10-5-3-9(4-6-10)8-11-2-1-7-13-11/h1-7,12H,8H2
InChIKeyYHOIZMRUUWRATR-UHFFFAOYSA-N
XLogP3.04
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(thiophen-2-ylmethyl)phenol 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 4-(thiophen-2-ylmethyl)phenol?
The IUPAC name of 4-(thiophen-2-ylmethyl)phenol (CID 605440) is 4-(thiophen-2-ylmethyl)phenol.
What is the SMILES notation for 4-(thiophen-2-ylmethyl)phenol?
The canonical SMILES for 4-(thiophen-2-ylmethyl)phenol is Oc1ccc(Cc2cccs2)cc1.
What is the InChIKey of 4-(thiophen-2-ylmethyl)phenol?
The InChIKey is YHOIZMRUUWRATR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10OS/c12-10-5-3-9(4-6-10)8-11-2-1-7-13-11/h1-7,12H,8H2.
What are the key properties of 4-(thiophen-2-ylmethyl)phenol?
4-(thiophen-2-ylmethyl)phenol has a molecular weight of 190.27 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(thiophen-2-ylmethyl)phenol is sourced from PubChem (CID 605440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).