1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole

C20H19ClN2O — CID 6476079

IUPAC1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole
SMILESClc1ccc(C(Cn2ccnc2)OC/C=C/c2ccccc2)cc1
InChIInChI=1S/C20H19ClN2O/c21-19-10-8-18(9-11-19)20(15-23-13-12-22-16-23)24-14-4-7-17-5-2-1-3-6-17/h1-13,16,20H,14-15H2/b7-4+
InChIKeyHGOPFYKRFOFCIT-QPJJXVBHSA-N
MW338.84 g/mol
LogP5.01
Rot. Bonds7

About 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole

1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole (PubChem CID 6476079) has the molecular formula C20H19ClN2O and a molecular weight of 338.84 g/mol. Its IUPAC name is 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole.

Molecular Properties

Compound Name1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole
PubChem CID6476079
Molecular FormulaC20H19ClN2O
Molecular Weight338.84 g/mol
Exact Mass338.12
IUPAC Name1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole
SMILESClc1ccc(C(Cn2ccnc2)OC/C=C/c2ccccc2)cc1
InChIInChI=1S/C20H19ClN2O/c21-19-10-8-18(9-11-19)20(15-23-13-12-22-16-23)24-14-4-7-17-5-2-1-3-6-17/h1-13,16,20H,14-15H2/b7-4+
InChIKeyHGOPFYKRFOFCIT-QPJJXVBHSA-N
XLogP5.01
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.84
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]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

Related Compounds

1-[3-[3-(4-chlorophenyl)prop-2-enoxy]-3-(4-fluorophenyl)propyl]imidazole
CID 54296623
1-[3-(4-tert-butylphenyl)-3-(3-phenylprop-2-enoxy)propyl]imidazole
CID 54189128
1-[2-(4-chlorophenyl)-2-[(4-chlorophenyl)methoxy]ethyl]imidazole
CID 21443191
1-[4-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enyl]sulfanylbut-3-enyl]imidazole
CID 70630028
1-(3-phenylprop-2-enyl)imidazole;hydrochloride
CID 174925347
1-[4-(4-chlorophenyl)-2-undecoxybut-3-enyl]imidazole
CID 54487741
1-[3-[3-(4-chlorophenyl)prop-2-enoxy]-4-(4-methylphenyl)butyl]imidazole
CID 54505880
1-[(E)-2-dodecoxy-4-phenylbut-3-enyl]imidazole
CID 21415287
1-[2-(2,4-dichlorophenyl)-2-[(4-phenylphenoxy)methoxy]ethyl]imidazole
CID 3054902
[1-(4-chlorophenyl)-2-imidazol-1-ylethyl] octanoate
CID 21422355
1-[2-[3-(4-chlorophenoxy)propoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole
CID 3054320
(2-imidazol-1-yl-1-phenylethyl) acetate
CID 3242727

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole?
The IUPAC name of 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole (CID 6476079) is 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole.
What is the SMILES notation for 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole?
The canonical SMILES for 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole is Clc1ccc(C(Cn2ccnc2)OC/C=C/c2ccccc2)cc1.
What is the InChIKey of 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole?
The InChIKey is HGOPFYKRFOFCIT-QPJJXVBHSA-N. The full InChI is InChI=1S/C20H19ClN2O/c21-19-10-8-18(9-11-19)20(15-23-13-12-22-16-23)24-14-4-7-17-5-2-1-3-6-17/h1-13,16,20H,14-15H2/b7-4+.
What are the key properties of 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole?
1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole has a molecular weight of 338.84 g/mol, XLogP of 5.01, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-chlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole is sourced from PubChem (CID 6476079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).