(5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one

C24H19FO — CID 42628094

IUPAC(5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one
SMILESO=C1C=C(c2ccc(-c3ccccc3)cc2)C[C@@H](c2ccc(F)cc2)C1
InChIInChI=1S/C24H19FO/c25-23-12-10-20(11-13-23)22-14-21(15-24(26)16-22)19-8-6-18(7-9-19)17-4-2-1-3-5-17/h1-13,15,22H,14,16H2/t22-/m1/s1
InChIKeyHGIXPDAIYRHISR-JOCHJYFZSA-N
MW342.41 g/mol
LogP6.02
Rot. Bonds3

About (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one

(5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one (PubChem CID 42628094) has the molecular formula C24H19FO and a molecular weight of 342.41 g/mol. Its IUPAC name is (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one.

Molecular Properties

Compound Name(5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one
PubChem CID42628094
Molecular FormulaC24H19FO
Molecular Weight342.41 g/mol
Exact Mass342.14
IUPAC Name(5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one
SMILESO=C1C=C(c2ccc(-c3ccccc3)cc2)C[C@@H](c2ccc(F)cc2)C1
InChIInChI=1S/C24H19FO/c25-23-12-10-20(11-13-23)22-14-21(15-24(26)16-22)19-8-6-18(7-9-19)17-4-2-1-3-5-17/h1-13,15,22H,14,16H2/t22-/m1/s1
InChIKeyHGIXPDAIYRHISR-JOCHJYFZSA-N
XLogP6.02
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.41
LogP ≤ 56.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one 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 (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one?
The IUPAC name of (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one (CID 42628094) is (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one.
What is the SMILES notation for (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one?
The canonical SMILES for (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one is O=C1C=C(c2ccc(-c3ccccc3)cc2)C[C@@H](c2ccc(F)cc2)C1.
What is the InChIKey of (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one?
The InChIKey is HGIXPDAIYRHISR-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H19FO/c25-23-12-10-20(11-13-23)22-14-21(15-24(26)16-22)19-8-6-18(7-9-19)17-4-2-1-3-5-17/h1-13,15,22H,14,16H2/t22-/m1/s1.
What are the key properties of (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one?
(5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one has a molecular weight of 342.41 g/mol, XLogP of 6.02, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(4-fluorophenyl)-3-(4-phenylphenyl)cyclohex-2-en-1-one is sourced from PubChem (CID 42628094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).