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

C17H12N2O — CID 135677613

IUPAC1-(1H-benzimidazol-2-yl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc2ccccc2[nH]1
InChIInChI=1S/C17H12N2O/c20-15-10-9-11-5-1-2-6-12(11)16(15)17-18-13-7-3-4-8-14(13)19-17/h1-10,20H,(H,18,19)
InChIKeyKHBKKJOTFZKPLZ-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.09
Rot. Bonds1

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

1-(1H-benzimidazol-2-yl)naphthalen-2-ol (PubChem CID 135677613) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 1-(1H-benzimidazol-2-yl)naphthalen-2-ol.

Molecular Properties

Compound Name1-(1H-benzimidazol-2-yl)naphthalen-2-ol
PubChem CID135677613
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name1-(1H-benzimidazol-2-yl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1nc2ccccc2[nH]1
InChIInChI=1S/C17H12N2O/c20-15-10-9-11-5-1-2-6-12(11)16(15)17-18-13-7-3-4-8-14(13)19-17/h1-10,20H,(H,18,19)
InChIKeyKHBKKJOTFZKPLZ-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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Frequently Asked Questions

What is the IUPAC name of 1-(1H-benzimidazol-2-yl)naphthalen-2-ol?
The IUPAC name of 1-(1H-benzimidazol-2-yl)naphthalen-2-ol (CID 135677613) is 1-(1H-benzimidazol-2-yl)naphthalen-2-ol.
What is the SMILES notation for 1-(1H-benzimidazol-2-yl)naphthalen-2-ol?
The canonical SMILES for 1-(1H-benzimidazol-2-yl)naphthalen-2-ol is Oc1ccc2ccccc2c1-c1nc2ccccc2[nH]1.
What is the InChIKey of 1-(1H-benzimidazol-2-yl)naphthalen-2-ol?
The InChIKey is KHBKKJOTFZKPLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c20-15-10-9-11-5-1-2-6-12(11)16(15)17-18-13-7-3-4-8-14(13)19-17/h1-10,20H,(H,18,19).
What are the key properties of 1-(1H-benzimidazol-2-yl)naphthalen-2-ol?
1-(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 1-(1H-benzimidazol-2-yl)naphthalen-2-ol is sourced from PubChem (CID 135677613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).