3-(1H-benzimidazol-2-yl)naphthalen-2-ol

C17H12N2O — CID 135803003

IUPAC3-(1H-benzimidazol-2-yl)naphthalen-2-ol
SMILESOc1cc2ccccc2cc1-c1nc2ccccc2[nH]1
InChIInChI=1S/C17H12N2O/c20-16-10-12-6-2-1-5-11(12)9-13(16)17-18-14-7-3-4-8-15(14)19-17/h1-10,20H,(H,18,19)
InChIKeyGSJNUIQEWCYTGV-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.09
Rot. Bonds1

About 3-(1H-benzimidazol-2-yl)naphthalen-2-ol

3-(1H-benzimidazol-2-yl)naphthalen-2-ol (PubChem CID 135803003) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 3-(1H-benzimidazol-2-yl)naphthalen-2-ol.

Molecular Properties

Compound Name3-(1H-benzimidazol-2-yl)naphthalen-2-ol
PubChem CID135803003
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name3-(1H-benzimidazol-2-yl)naphthalen-2-ol
SMILESOc1cc2ccccc2cc1-c1nc2ccccc2[nH]1
InChIInChI=1S/C17H12N2O/c20-16-10-12-6-2-1-5-11(12)9-13(16)17-18-14-7-3-4-8-15(14)19-17/h1-10,20H,(H,18,19)
InChIKeyGSJNUIQEWCYTGV-UHFFFAOYSA-N
XLogP4.09
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(1H-benzimidazol-2-yl)naphthalen-2-ol 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 3-(1H-benzimidazol-2-yl)naphthalen-2-ol?
The IUPAC name of 3-(1H-benzimidazol-2-yl)naphthalen-2-ol (CID 135803003) is 3-(1H-benzimidazol-2-yl)naphthalen-2-ol.
What is the SMILES notation for 3-(1H-benzimidazol-2-yl)naphthalen-2-ol?
The canonical SMILES for 3-(1H-benzimidazol-2-yl)naphthalen-2-ol is Oc1cc2ccccc2cc1-c1nc2ccccc2[nH]1.
What is the InChIKey of 3-(1H-benzimidazol-2-yl)naphthalen-2-ol?
The InChIKey is GSJNUIQEWCYTGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c20-16-10-12-6-2-1-5-11(12)9-13(16)17-18-14-7-3-4-8-15(14)19-17/h1-10,20H,(H,18,19).
What are the key properties of 3-(1H-benzimidazol-2-yl)naphthalen-2-ol?
3-(1H-benzimidazol-2-yl)naphthalen-2-ol has a molecular weight of 260.30 g/mol, XLogP of 4.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-benzimidazol-2-yl)naphthalen-2-ol is sourced from PubChem (CID 135803003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).