4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile

C20H14N4 — CID 23365327

IUPAC4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile
SMILESN#Cc1ccc(/C=C(\Cn2ccnc2)c2ccc(C#N)cc2)cc1
InChIInChI=1S/C20H14N4/c21-12-17-3-1-16(2-4-17)11-20(14-24-10-9-23-15-24)19-7-5-18(13-22)6-8-19/h1-11,15H,14H2/b20-11+
InChIKeySFJCUVDZZXWXEF-RGVLZGJSSA-N
MW310.36 g/mol
LogP3.87
Rot. Bonds4

About 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile

4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile (PubChem CID 23365327) has the molecular formula C20H14N4 and a molecular weight of 310.36 g/mol. Its IUPAC name is 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile.

Molecular Properties

Compound Name4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile
PubChem CID23365327
Molecular FormulaC20H14N4
Molecular Weight310.36 g/mol
Exact Mass310.12
IUPAC Name4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile
SMILESN#Cc1ccc(/C=C(\Cn2ccnc2)c2ccc(C#N)cc2)cc1
InChIInChI=1S/C20H14N4/c21-12-17-3-1-16(2-4-17)11-20(14-24-10-9-23-15-24)19-7-5-18(13-22)6-8-19/h1-11,15H,14H2/b20-11+
InChIKeySFJCUVDZZXWXEF-RGVLZGJSSA-N
XLogP3.87
TPSA65.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile 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

4-[(Z)-2-(4-fluorophenyl)-3-imidazol-1-ylprop-1-enyl]benzoic acid
CID 18474516
2-(4-fluorophenyl)-4-[2-(4-fluorophenyl)-3-imidazol-1-ylprop-1-enyl]benzoic acid
CID 54273924
4-(1-imidazol-1-ylethenyl)benzonitrile
CID 11819989
(2S)-5-amino-2-[[4-[(E)-2-(4-fluorophenyl)-3-imidazol-1-ylprop-1-enyl]benzoyl]amino]-5-oxopentanoic acid
CID 70168851
4-[2-(imidazole-1-carbonyl)-3,3-dimethylbut-1-enyl]benzonitrile
CID 54286831
4-[(Z)-2-(4-cyanophenyl)-3-(5-methyl-1H-imidazol-2-yl)prop-1-enyl]benzonitrile
CID 69125371
4-[[4-(8-imidazol-1-yloctoxy)phenyl]diazenyl]benzonitrile
CID 101189546
(2S)-2-[[2-(4-fluorophenyl)-4-[(E)-2-(4-fluorophenyl)-3-imidazol-1-ylprop-1-enyl]benzoyl]amino]propanoic acid
CID 70168870
4-[cycloheptylidene(imidazol-1-yl)methyl]benzonitrile
CID 14852897
3-hydroxy-2-(imidazol-1-ylmethyl)-2,3-dihydro-1-benzothiophene-5-carbonitrile
CID 70351436
[1-(4-cyanophenoxy)-3-imidazol-1-ylpropan-2-yl] 4-iodobenzoate
CID 10183864
1-[2-(4-chlorophenyl)prop-2-enyl]imidazole
CID 71322821

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile?
The IUPAC name of 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile (CID 23365327) is 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile.
What is the SMILES notation for 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile?
The canonical SMILES for 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile is N#Cc1ccc(/C=C(\Cn2ccnc2)c2ccc(C#N)cc2)cc1.
What is the InChIKey of 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile?
The InChIKey is SFJCUVDZZXWXEF-RGVLZGJSSA-N. The full InChI is InChI=1S/C20H14N4/c21-12-17-3-1-16(2-4-17)11-20(14-24-10-9-23-15-24)19-7-5-18(13-22)6-8-19/h1-11,15H,14H2/b20-11+.
What are the key properties of 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile?
4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile has a molecular weight of 310.36 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-2-(4-cyanophenyl)-3-imidazol-1-ylprop-1-enyl]benzonitrile is sourced from PubChem (CID 23365327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).