5-(4-methoxyphenyl)-2-phenyl-1H-imidazole

C16H14N2O — CID 12024852

IUPAC5-(4-methoxyphenyl)-2-phenyl-1H-imidazole
SMILESCOc1ccc(-c2cnc(-c3ccccc3)[nH]2)cc1
InChIInChI=1S/C16H14N2O/c1-19-14-9-7-12(8-10-14)15-11-17-16(18-15)13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18)
InChIKeyZJUBRROOFQATFF-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.75
Rot. Bonds3

About 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole

5-(4-methoxyphenyl)-2-phenyl-1H-imidazole (PubChem CID 12024852) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-2-phenyl-1H-imidazole
PubChem CID12024852
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name5-(4-methoxyphenyl)-2-phenyl-1H-imidazole
SMILESCOc1ccc(-c2cnc(-c3ccccc3)[nH]2)cc1
InChIInChI=1S/C16H14N2O/c1-19-14-9-7-12(8-10-14)15-11-17-16(18-15)13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18)
InChIKeyZJUBRROOFQATFF-UHFFFAOYSA-N
XLogP3.75
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole?
The IUPAC name of 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole (CID 12024852) is 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole.
What is the SMILES notation for 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole?
The canonical SMILES for 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole is COc1ccc(-c2cnc(-c3ccccc3)[nH]2)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole?
The InChIKey is ZJUBRROOFQATFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-19-14-9-7-12(8-10-14)15-11-17-16(18-15)13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18).
What are the key properties of 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole?
5-(4-methoxyphenyl)-2-phenyl-1H-imidazole has a molecular weight of 250.30 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-2-phenyl-1H-imidazole is sourced from PubChem (CID 12024852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).