2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole

C16H12N2O2 — CID 65017699

IUPAC2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole
SMILESCOc1ccc2nc(-c3cc4ccccc4o3)[nH]c2c1
InChIInChI=1S/C16H12N2O2/c1-19-11-6-7-12-13(9-11)18-16(17-12)15-8-10-4-2-3-5-14(10)20-15/h2-9H,1H3,(H,17,18)
InChIKeyPIQWVWREKREPKD-UHFFFAOYSA-N
MW264.28 g/mol
LogP3.98
Rot. Bonds2

About 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole

2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole (PubChem CID 65017699) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole.

Molecular Properties

Compound Name2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole
PubChem CID65017699
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole
SMILESCOc1ccc2nc(-c3cc4ccccc4o3)[nH]c2c1
InChIInChI=1S/C16H12N2O2/c1-19-11-6-7-12-13(9-11)18-16(17-12)15-8-10-4-2-3-5-14(10)20-15/h2-9H,1H3,(H,17,18)
InChIKeyPIQWVWREKREPKD-UHFFFAOYSA-N
XLogP3.98
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole?
The IUPAC name of 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole (CID 65017699) is 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole.
What is the SMILES notation for 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole?
The canonical SMILES for 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole is COc1ccc2nc(-c3cc4ccccc4o3)[nH]c2c1.
What is the InChIKey of 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole?
The InChIKey is PIQWVWREKREPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c1-19-11-6-7-12-13(9-11)18-16(17-12)15-8-10-4-2-3-5-14(10)20-15/h2-9H,1H3,(H,17,18).
What are the key properties of 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole?
2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole has a molecular weight of 264.28 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzofuran-2-yl)-6-methoxy-1H-benzimidazole is sourced from PubChem (CID 65017699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).