2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole

C17H12N2O — CID 44588577

IUPAC2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole
SMILESc1ccc(-c2cnc(-c3cc4ccccc4o3)[nH]2)cc1
InChIInChI=1S/C17H12N2O/c1-2-6-12(7-3-1)14-11-18-17(19-14)16-10-13-8-4-5-9-15(13)20-16/h1-11H,(H,18,19)
InChIKeyUWKHQZKCGYBCHR-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.49
Rot. Bonds2

About 2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole

2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole (PubChem CID 44588577) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole.

Molecular Properties

Compound Name2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole
PubChem CID44588577
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole
SMILESc1ccc(-c2cnc(-c3cc4ccccc4o3)[nH]2)cc1
InChIInChI=1S/C17H12N2O/c1-2-6-12(7-3-1)14-11-18-17(19-14)16-10-13-8-4-5-9-15(13)20-16/h1-11H,(H,18,19)
InChIKeyUWKHQZKCGYBCHR-UHFFFAOYSA-N
XLogP4.49
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 54.49
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)-5-phenyl-1H-imidazole?
The IUPAC name of 2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole (CID 44588577) is 2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole.
What is the SMILES notation for 2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole?
The canonical SMILES for 2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole is c1ccc(-c2cnc(-c3cc4ccccc4o3)[nH]2)cc1.
What is the InChIKey of 2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole?
The InChIKey is UWKHQZKCGYBCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-2-6-12(7-3-1)14-11-18-17(19-14)16-10-13-8-4-5-9-15(13)20-16/h1-11H,(H,18,19).
What are the key properties of 2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole?
2-(1-benzofuran-2-yl)-5-phenyl-1H-imidazole has a molecular weight of 260.30 g/mol, XLogP of 4.49, 2 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)-5-phenyl-1H-imidazole is sourced from PubChem (CID 44588577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).