4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine

C24H19FN2 — CID 121481872

IUPAC4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine
SMILESFc1cc(CCc2ccc(-c3ccncc3)cc2)cc(-c2ccncc2)c1
InChIInChI=1S/C24H19FN2/c25-24-16-19(15-23(17-24)22-9-13-27-14-10-22)2-1-18-3-5-20(6-4-18)21-7-11-26-12-8-21/h3-17H,1-2H2
InChIKeyBEOPIADEMINPBA-UHFFFAOYSA-N
MW354.43 g/mol
LogP5.73
Rot. Bonds5

About 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine

4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine (PubChem CID 121481872) has the molecular formula C24H19FN2 and a molecular weight of 354.43 g/mol. Its IUPAC name is 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine.

Molecular Properties

Compound Name4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine
PubChem CID121481872
Molecular FormulaC24H19FN2
Molecular Weight354.43 g/mol
Exact Mass354.15
IUPAC Name4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine
SMILESFc1cc(CCc2ccc(-c3ccncc3)cc2)cc(-c2ccncc2)c1
InChIInChI=1S/C24H19FN2/c25-24-16-19(15-23(17-24)22-9-13-27-14-10-22)2-1-18-3-5-20(6-4-18)21-7-11-26-12-8-21/h3-17H,1-2H2
InChIKeyBEOPIADEMINPBA-UHFFFAOYSA-N
XLogP5.73
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.43
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine?
The IUPAC name of 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine (CID 121481872) is 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine.
What is the SMILES notation for 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine?
The canonical SMILES for 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine is Fc1cc(CCc2ccc(-c3ccncc3)cc2)cc(-c2ccncc2)c1.
What is the InChIKey of 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine?
The InChIKey is BEOPIADEMINPBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN2/c25-24-16-19(15-23(17-24)22-9-13-27-14-10-22)2-1-18-3-5-20(6-4-18)21-7-11-26-12-8-21/h3-17H,1-2H2.
What are the key properties of 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine?
4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine has a molecular weight of 354.43 g/mol, XLogP of 5.73, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-fluoro-5-[2-(4-pyridin-4-ylphenyl)ethyl]phenyl]pyridine is sourced from PubChem (CID 121481872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).