1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole

C18H18N2O — CID 71421283

IUPAC1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole
SMILESc1ccc(COc2ccc(CCn3ccnc3)cc2)cc1
InChIInChI=1S/C18H18N2O/c1-2-4-17(5-3-1)14-21-18-8-6-16(7-9-18)10-12-20-13-11-19-15-20/h1-9,11,13,15H,10,12,14H2
InChIKeyZGPCRMIIWBZNGF-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.70
Rot. Bonds6

About 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole

1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole (PubChem CID 71421283) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole.

Molecular Properties

Compound Name1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole
PubChem CID71421283
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole
SMILESc1ccc(COc2ccc(CCn3ccnc3)cc2)cc1
InChIInChI=1S/C18H18N2O/c1-2-4-17(5-3-1)14-21-18-8-6-16(7-9-18)10-12-20-13-11-19-15-20/h1-9,11,13,15H,10,12,14H2
InChIKeyZGPCRMIIWBZNGF-UHFFFAOYSA-N
XLogP3.70
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole?
The IUPAC name of 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole (CID 71421283) is 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole.
What is the SMILES notation for 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole?
The canonical SMILES for 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole is c1ccc(COc2ccc(CCn3ccnc3)cc2)cc1.
What is the InChIKey of 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole?
The InChIKey is ZGPCRMIIWBZNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-2-4-17(5-3-1)14-21-18-8-6-16(7-9-18)10-12-20-13-11-19-15-20/h1-9,11,13,15H,10,12,14H2.
What are the key properties of 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole?
1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole has a molecular weight of 278.36 g/mol, XLogP of 3.70, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole is sourced from PubChem (CID 71421283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).