1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole

C18H17ClN2 — CID 71393269

IUPAC1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole
SMILESClc1ccccc1CC(Cn1ccnc1)c1ccccc1
InChIInChI=1S/C18H17ClN2/c19-18-9-5-4-8-16(18)12-17(13-21-11-10-20-14-21)15-6-2-1-3-7-15/h1-11,14,17H,12-13H2
InChIKeyKYZNKFPUIIEEQI-UHFFFAOYSA-N
MW296.80 g/mol
LogP4.56
Rot. Bonds5

About 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole

1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole (PubChem CID 71393269) has the molecular formula C18H17ClN2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole.

Molecular Properties

Compound Name1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole
PubChem CID71393269
Molecular FormulaC18H17ClN2
Molecular Weight296.80 g/mol
Exact Mass296.11
IUPAC Name1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole
SMILESClc1ccccc1CC(Cn1ccnc1)c1ccccc1
InChIInChI=1S/C18H17ClN2/c19-18-9-5-4-8-16(18)12-17(13-21-11-10-20-14-21)15-6-2-1-3-7-15/h1-11,14,17H,12-13H2
InChIKeyKYZNKFPUIIEEQI-UHFFFAOYSA-N
XLogP4.56
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[3-(2-chlorophenyl)-2-phenylpropyl]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-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole?
The IUPAC name of 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole (CID 71393269) is 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole.
What is the SMILES notation for 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole?
The canonical SMILES for 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole is Clc1ccccc1CC(Cn1ccnc1)c1ccccc1.
What is the InChIKey of 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole?
The InChIKey is KYZNKFPUIIEEQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2/c19-18-9-5-4-8-16(18)12-17(13-21-11-10-20-14-21)15-6-2-1-3-7-15/h1-11,14,17H,12-13H2.
What are the key properties of 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole?
1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole has a molecular weight of 296.80 g/mol, XLogP of 4.56, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-chlorophenyl)-2-phenylpropyl]imidazole is sourced from PubChem (CID 71393269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).