2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole

C16H12N2O2 — CID 650866

IUPAC2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole
SMILESc1coc(Cn2c(-c3ccco3)nc3ccccc32)c1
InChIInChI=1S/C16H12N2O2/c1-2-7-14-13(6-1)17-16(15-8-4-10-20-15)18(14)11-12-5-3-9-19-12/h1-10H,11H2
InChIKeyBBKODUSYDNJJKK-UHFFFAOYSA-N
MW264.28 g/mol
LogP3.94
Rot. Bonds3

About 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole

2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole (PubChem CID 650866) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole.

Molecular Properties

Compound Name2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole
PubChem CID650866
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole
SMILESc1coc(Cn2c(-c3ccco3)nc3ccccc32)c1
InChIInChI=1S/C16H12N2O2/c1-2-7-14-13(6-1)17-16(15-8-4-10-20-15)18(14)11-12-5-3-9-19-12/h1-10H,11H2
InChIKeyBBKODUSYDNJJKK-UHFFFAOYSA-N
XLogP3.94
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole?
The IUPAC name of 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole (CID 650866) is 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole.
What is the SMILES notation for 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole?
The canonical SMILES for 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole is c1coc(Cn2c(-c3ccco3)nc3ccccc32)c1.
What is the InChIKey of 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole?
The InChIKey is BBKODUSYDNJJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c1-2-7-14-13(6-1)17-16(15-8-4-10-20-15)18(14)11-12-5-3-9-19-12/h1-10H,11H2.
What are the key properties of 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole?
2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole has a molecular weight of 264.28 g/mol, XLogP of 3.94, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole is sourced from PubChem (CID 650866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).