1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene

C23H23F — CID 20719160

IUPAC1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene
SMILESCCCc1ccc(-c2ccc(-c3ccc(CC)cc3)c(F)c2)cc1
InChIInChI=1S/C23H23F/c1-3-5-18-8-10-19(11-9-18)21-14-15-22(23(24)16-21)20-12-6-17(4-2)7-13-20/h6-16H,3-5H2,1-2H3
InChIKeyCVIAWUYXXOUERK-UHFFFAOYSA-N
MW318.44 g/mol
LogP6.67
Rot. Bonds5

About 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene

1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene (PubChem CID 20719160) has the molecular formula C23H23F and a molecular weight of 318.44 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene.

Molecular Properties

Compound Name1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene
PubChem CID20719160
Molecular FormulaC23H23F
Molecular Weight318.44 g/mol
Exact Mass318.18
IUPAC Name1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene
SMILESCCCc1ccc(-c2ccc(-c3ccc(CC)cc3)c(F)c2)cc1
InChIInChI=1S/C23H23F/c1-3-5-18-8-10-19(11-9-18)21-14-15-22(23(24)16-21)20-12-6-17(4-2)7-13-20/h6-16H,3-5H2,1-2H3
InChIKeyCVIAWUYXXOUERK-UHFFFAOYSA-N
XLogP6.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.44
LogP ≤ 56.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene 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-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene?
The IUPAC name of 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene (CID 20719160) is 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene.
What is the SMILES notation for 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene?
The canonical SMILES for 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene is CCCc1ccc(-c2ccc(-c3ccc(CC)cc3)c(F)c2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene?
The InChIKey is CVIAWUYXXOUERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23F/c1-3-5-18-8-10-19(11-9-18)21-14-15-22(23(24)16-21)20-12-6-17(4-2)7-13-20/h6-16H,3-5H2,1-2H3.
What are the key properties of 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene?
1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene has a molecular weight of 318.44 g/mol, XLogP of 6.67, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-2-fluoro-4-(4-propylphenyl)benzene is sourced from PubChem (CID 20719160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).