1-[(3-phenylphenyl)methyl]imidazole

C16H14N2 — CID 53324450

IUPAC1-[(3-phenylphenyl)methyl]imidazole
SMILESc1ccc(-c2cccc(Cn3ccnc3)c2)cc1
InChIInChI=1S/C16H14N2/c1-2-6-15(7-3-1)16-8-4-5-14(11-16)12-18-10-9-17-13-18/h1-11,13H,12H2
InChIKeyFMBIBQYJJRROCK-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.60
Rot. Bonds3

About 1-[(3-phenylphenyl)methyl]imidazole

1-[(3-phenylphenyl)methyl]imidazole (PubChem CID 53324450) has the molecular formula C16H14N2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 1-[(3-phenylphenyl)methyl]imidazole.

Molecular Properties

Compound Name1-[(3-phenylphenyl)methyl]imidazole
PubChem CID53324450
Molecular FormulaC16H14N2
Molecular Weight234.30 g/mol
Exact Mass234.12
IUPAC Name1-[(3-phenylphenyl)methyl]imidazole
SMILESc1ccc(-c2cccc(Cn3ccnc3)c2)cc1
InChIInChI=1S/C16H14N2/c1-2-6-15(7-3-1)16-8-4-5-14(11-16)12-18-10-9-17-13-18/h1-11,13H,12H2
InChIKeyFMBIBQYJJRROCK-UHFFFAOYSA-N
XLogP3.60
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(3-phenylphenyl)methyl]imidazole?
The IUPAC name of 1-[(3-phenylphenyl)methyl]imidazole (CID 53324450) is 1-[(3-phenylphenyl)methyl]imidazole.
What is the SMILES notation for 1-[(3-phenylphenyl)methyl]imidazole?
The canonical SMILES for 1-[(3-phenylphenyl)methyl]imidazole is c1ccc(-c2cccc(Cn3ccnc3)c2)cc1.
What is the InChIKey of 1-[(3-phenylphenyl)methyl]imidazole?
The InChIKey is FMBIBQYJJRROCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2/c1-2-6-15(7-3-1)16-8-4-5-14(11-16)12-18-10-9-17-13-18/h1-11,13H,12H2.
What are the key properties of 1-[(3-phenylphenyl)methyl]imidazole?
1-[(3-phenylphenyl)methyl]imidazole has a molecular weight of 234.30 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-phenylphenyl)methyl]imidazole is sourced from PubChem (CID 53324450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).