1-(2,2,2-triphenylethyl)imidazole

C23H20N2 — CID 53325760

IUPAC1-(2,2,2-triphenylethyl)imidazole
SMILESc1ccc(C(Cn2ccnc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H20N2/c1-4-10-20(11-5-1)23(18-25-17-16-24-19-25,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-17,19H,18H2
InChIKeyXJIOQTLPOYOEEQ-UHFFFAOYSA-N
MW324.43 g/mol
LogP4.92
Rot. Bonds5

About 1-(2,2,2-triphenylethyl)imidazole

1-(2,2,2-triphenylethyl)imidazole (PubChem CID 53325760) has the molecular formula C23H20N2 and a molecular weight of 324.43 g/mol. Its IUPAC name is 1-(2,2,2-triphenylethyl)imidazole.

Molecular Properties

Compound Name1-(2,2,2-triphenylethyl)imidazole
PubChem CID53325760
Molecular FormulaC23H20N2
Molecular Weight324.43 g/mol
Exact Mass324.16
IUPAC Name1-(2,2,2-triphenylethyl)imidazole
SMILESc1ccc(C(Cn2ccnc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H20N2/c1-4-10-20(11-5-1)23(18-25-17-16-24-19-25,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-17,19H,18H2
InChIKeyXJIOQTLPOYOEEQ-UHFFFAOYSA-N
XLogP4.92
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2,2-triphenylethyl)imidazole?
The IUPAC name of 1-(2,2,2-triphenylethyl)imidazole (CID 53325760) is 1-(2,2,2-triphenylethyl)imidazole.
What is the SMILES notation for 1-(2,2,2-triphenylethyl)imidazole?
The canonical SMILES for 1-(2,2,2-triphenylethyl)imidazole is c1ccc(C(Cn2ccnc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 1-(2,2,2-triphenylethyl)imidazole?
The InChIKey is XJIOQTLPOYOEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2/c1-4-10-20(11-5-1)23(18-25-17-16-24-19-25,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-17,19H,18H2.
What are the key properties of 1-(2,2,2-triphenylethyl)imidazole?
1-(2,2,2-triphenylethyl)imidazole has a molecular weight of 324.43 g/mol, XLogP of 4.92, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,2-triphenylethyl)imidazole is sourced from PubChem (CID 53325760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).