2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol

C9H10N2OS — CID 61082639

IUPAC2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol
SMILESOC(Cc1ncc[nH]1)c1ccsc1
InChIInChI=1S/C9H10N2OS/c12-8(7-1-4-13-6-7)5-9-10-2-3-11-9/h1-4,6,8,12H,5H2,(H,10,11)
InChIKeyHPZBQOBWABEYJO-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.75
Rot. Bonds3

About 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol

2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol (PubChem CID 61082639) has the molecular formula C9H10N2OS and a molecular weight of 194.26 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol
PubChem CID61082639
Molecular FormulaC9H10N2OS
Molecular Weight194.26 g/mol
Exact Mass194.05
IUPAC Name2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol
SMILESOC(Cc1ncc[nH]1)c1ccsc1
InChIInChI=1S/C9H10N2OS/c12-8(7-1-4-13-6-7)5-9-10-2-3-11-9/h1-4,6,8,12H,5H2,(H,10,11)
InChIKeyHPZBQOBWABEYJO-UHFFFAOYSA-N
XLogP1.75
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1H-imidazol-2-yl)-1-thiophen-3-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 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol?
The IUPAC name of 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol (CID 61082639) is 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol?
The canonical SMILES for 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol is OC(Cc1ncc[nH]1)c1ccsc1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol?
The InChIKey is HPZBQOBWABEYJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2OS/c12-8(7-1-4-13-6-7)5-9-10-2-3-11-9/h1-4,6,8,12H,5H2,(H,10,11).
What are the key properties of 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol?
2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol has a molecular weight of 194.26 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-1-thiophen-3-ylethanol is sourced from PubChem (CID 61082639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).