2-(1-benzofuran-2-yl)-1H-imidazole

C11H8N2O — CID 3073596

IUPAC2-(1-benzofuran-2-yl)-1H-imidazole
SMILESc1ccc2oc(-c3ncc[nH]3)cc2c1
InChIInChI=1S/C11H8N2O/c1-2-4-9-8(3-1)7-10(14-9)11-12-5-6-13-11/h1-7H,(H,12,13)
InChIKeyVBFQIUOSXHUWCT-UHFFFAOYSA-N
MW184.20 g/mol
LogP2.82
Rot. Bonds1

About 2-(1-benzofuran-2-yl)-1H-imidazole

2-(1-benzofuran-2-yl)-1H-imidazole (PubChem CID 3073596) has the molecular formula C11H8N2O and a molecular weight of 184.20 g/mol. Its IUPAC name is 2-(1-benzofuran-2-yl)-1H-imidazole.

Molecular Properties

Compound Name2-(1-benzofuran-2-yl)-1H-imidazole
PubChem CID3073596
Molecular FormulaC11H8N2O
Molecular Weight184.20 g/mol
Exact Mass184.06
IUPAC Name2-(1-benzofuran-2-yl)-1H-imidazole
SMILESc1ccc2oc(-c3ncc[nH]3)cc2c1
InChIInChI=1S/C11H8N2O/c1-2-4-9-8(3-1)7-10(14-9)11-12-5-6-13-11/h1-7H,(H,12,13)
InChIKeyVBFQIUOSXHUWCT-UHFFFAOYSA-N
XLogP2.82
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-benzofuran-2-yl)-1H-imidazole?
The IUPAC name of 2-(1-benzofuran-2-yl)-1H-imidazole (CID 3073596) is 2-(1-benzofuran-2-yl)-1H-imidazole.
What is the SMILES notation for 2-(1-benzofuran-2-yl)-1H-imidazole?
The canonical SMILES for 2-(1-benzofuran-2-yl)-1H-imidazole is c1ccc2oc(-c3ncc[nH]3)cc2c1.
What is the InChIKey of 2-(1-benzofuran-2-yl)-1H-imidazole?
The InChIKey is VBFQIUOSXHUWCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O/c1-2-4-9-8(3-1)7-10(14-9)11-12-5-6-13-11/h1-7H,(H,12,13).
What are the key properties of 2-(1-benzofuran-2-yl)-1H-imidazole?
2-(1-benzofuran-2-yl)-1H-imidazole has a molecular weight of 184.20 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzofuran-2-yl)-1H-imidazole is sourced from PubChem (CID 3073596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).