2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride

C11H9ClN2O2 — CID 3073609

IUPAC2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride
SMILESCl.Oc1ccc2oc(-c3ncc[nH]3)cc2c1
InChIInChI=1S/C11H8N2O2.ClH/c14-8-1-2-9-7(5-8)6-10(15-9)11-12-3-4-13-11;/h1-6,14H,(H,12,13);1H
InChIKeyKRNHJDSJKJSTHI-UHFFFAOYSA-N
MW236.66 g/mol
LogP2.95
Rot. Bonds1

About 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride

2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride (PubChem CID 3073609) has the molecular formula C11H9ClN2O2 and a molecular weight of 236.66 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride
PubChem CID3073609
Molecular FormulaC11H9ClN2O2
Molecular Weight236.66 g/mol
Exact Mass236.04
IUPAC Name2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride
SMILESCl.Oc1ccc2oc(-c3ncc[nH]3)cc2c1
InChIInChI=1S/C11H8N2O2.ClH/c14-8-1-2-9-7(5-8)6-10(15-9)11-12-3-4-13-11;/h1-6,14H,(H,12,13);1H
InChIKeyKRNHJDSJKJSTHI-UHFFFAOYSA-N
XLogP2.95
TPSA62.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.66
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride 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-benzofuran-5-ol;hydrochloride?
The IUPAC name of 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride (CID 3073609) is 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride?
The canonical SMILES for 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride is Cl.Oc1ccc2oc(-c3ncc[nH]3)cc2c1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride?
The InChIKey is KRNHJDSJKJSTHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O2.ClH/c14-8-1-2-9-7(5-8)6-10(15-9)11-12-3-4-13-11;/h1-6,14H,(H,12,13);1H.
What are the key properties of 2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride?
2-(1H-imidazol-2-yl)-1-benzofuran-5-ol;hydrochloride has a molecular weight of 236.66 g/mol, XLogP of 2.95, 1 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-benzofuran-5-ol;hydrochloride is sourced from PubChem (CID 3073609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).