2-naphthalen-1-yl-3H-benzimidazol-5-ol

C17H12N2O — CID 81432399

IUPAC2-naphthalen-1-yl-3H-benzimidazol-5-ol
SMILESOc1ccc2nc(-c3cccc4ccccc34)[nH]c2c1
InChIInChI=1S/C17H12N2O/c20-12-8-9-15-16(10-12)19-17(18-15)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,20H,(H,18,19)
InChIKeyFLNRAXZDVKYNIA-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.09
Rot. Bonds1

About 2-naphthalen-1-yl-3H-benzimidazol-5-ol

2-naphthalen-1-yl-3H-benzimidazol-5-ol (PubChem CID 81432399) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-naphthalen-1-yl-3H-benzimidazol-5-ol.

Molecular Properties

Compound Name2-naphthalen-1-yl-3H-benzimidazol-5-ol
PubChem CID81432399
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name2-naphthalen-1-yl-3H-benzimidazol-5-ol
SMILESOc1ccc2nc(-c3cccc4ccccc34)[nH]c2c1
InChIInChI=1S/C17H12N2O/c20-12-8-9-15-16(10-12)19-17(18-15)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,20H,(H,18,19)
InChIKeyFLNRAXZDVKYNIA-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

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Related Compounds

2-(2-bromophenyl)-3H-benzimidazol-5-ol
CID 81431199
2-(2-iodophenyl)-3H-benzimidazol-5-ol
CID 81431209
2-(3-hydroxy-2-methylphenyl)-3H-benzimidazol-5-ol
CID 82829837
6-methoxy-2-naphthalen-1-yl-1H-benzimidazole
CID 65017512
2-naphthalen-1-yl-6-(trifluoromethoxy)-1H-benzimidazole
CID 155599071
2-naphthalen-1-yl-3H-quinazolin-4-one
CID 135437423
2-[6-[2-(2-hydroxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]phenol
CID 159684416
2-(2-fluoro-6-hydroxyphenyl)-3H-benzimidazol-5-ol
CID 136959757
2-(5-bromo-2-methylphenyl)-3H-benzimidazol-5-ol
CID 81432484
2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol
CID 81432602
2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol
CID 106688315
2-pyrazolo[1,5-a]pyridin-3-yl-3H-benzimidazol-5-ol
CID 103119924

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-3H-benzimidazol-5-ol?
The IUPAC name of 2-naphthalen-1-yl-3H-benzimidazol-5-ol (CID 81432399) is 2-naphthalen-1-yl-3H-benzimidazol-5-ol.
What is the SMILES notation for 2-naphthalen-1-yl-3H-benzimidazol-5-ol?
The canonical SMILES for 2-naphthalen-1-yl-3H-benzimidazol-5-ol is Oc1ccc2nc(-c3cccc4ccccc34)[nH]c2c1.
What is the InChIKey of 2-naphthalen-1-yl-3H-benzimidazol-5-ol?
The InChIKey is FLNRAXZDVKYNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c20-12-8-9-15-16(10-12)19-17(18-15)14-7-3-5-11-4-1-2-6-13(11)14/h1-10,20H,(H,18,19).
What are the key properties of 2-naphthalen-1-yl-3H-benzimidazol-5-ol?
2-naphthalen-1-yl-3H-benzimidazol-5-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 2-naphthalen-1-yl-3H-benzimidazol-5-ol is sourced from PubChem (CID 81432399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).