About 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine
2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine (PubChem CID 171056601) has the molecular formula C29H20FN
and a molecular weight of 401.48 g/mol. Its IUPAC name is 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine.
Molecular Properties
| Compound Name | 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine |
| PubChem CID | 171056601 |
| Molecular Formula | C29H20FN |
| Molecular Weight | 401.48 g/mol |
| Exact Mass | 401.16 |
| IUPAC Name | 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine |
| SMILES | Fc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccccn5)cc4)cc3)cc2)cc1 |
| InChI | InChI=1S/C29H20FN/c30-28-18-16-26(17-19-28)24-10-8-22(9-11-24)21-4-6-23(7-5-21)25-12-14-27(15-13-25)29-3-1-2-20-31-29/h1-20H |
| InChIKey | RPHVDRRWWYJIQN-UHFFFAOYSA-N |
| XLogP | 7.89 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 31 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 401.48 |
| LogP ≤ 5 | 7.89 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine?
The IUPAC name of 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine (CID 171056601) is 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine.
What is the SMILES notation for 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine?
The canonical SMILES for 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine is Fc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccccn5)cc4)cc3)cc2)cc1.
What is the InChIKey of 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine?
The InChIKey is RPHVDRRWWYJIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H20FN/c30-28-18-16-26(17-19-28)24-10-8-22(9-11-24)21-4-6-23(7-5-21)25-12-14-27(15-13-25)29-3-1-2-20-31-29/h1-20H.
What are the key properties of 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine?
2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine has a molecular weight of 401.48 g/mol, XLogP of 7.89, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine is sourced from PubChem (CID 171056601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).