2-(benzimidazol-1-yl)phenol

C13H10N2O — CID 5328428

IUPAC2-(benzimidazol-1-yl)phenol
SMILESOc1ccccc1-n1cnc2ccccc21
InChIInChI=1S/C13H10N2O/c16-13-8-4-3-7-12(13)15-9-14-10-5-1-2-6-11(10)15/h1-9,16H
InChIKeyCVPOWJXYMCMMPD-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.73
Rot. Bonds1

About 2-(benzimidazol-1-yl)phenol

2-(benzimidazol-1-yl)phenol (PubChem CID 5328428) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)phenol.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)phenol
PubChem CID5328428
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name2-(benzimidazol-1-yl)phenol
SMILESOc1ccccc1-n1cnc2ccccc21
InChIInChI=1S/C13H10N2O/c16-13-8-4-3-7-12(13)15-9-14-10-5-1-2-6-11(10)15/h1-9,16H
InChIKeyCVPOWJXYMCMMPD-UHFFFAOYSA-N
XLogP2.73
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)phenol?
The IUPAC name of 2-(benzimidazol-1-yl)phenol (CID 5328428) is 2-(benzimidazol-1-yl)phenol.
What is the SMILES notation for 2-(benzimidazol-1-yl)phenol?
The canonical SMILES for 2-(benzimidazol-1-yl)phenol is Oc1ccccc1-n1cnc2ccccc21.
What is the InChIKey of 2-(benzimidazol-1-yl)phenol?
The InChIKey is CVPOWJXYMCMMPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c16-13-8-4-3-7-12(13)15-9-14-10-5-1-2-6-11(10)15/h1-9,16H.
What are the key properties of 2-(benzimidazol-1-yl)phenol?
2-(benzimidazol-1-yl)phenol has a molecular weight of 210.24 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)phenol is sourced from PubChem (CID 5328428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).