About 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine
2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine (PubChem CID 102052636) has the molecular formula C18H14FNO
and a molecular weight of 279.31 g/mol. Its IUPAC name is 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine.
Molecular Properties
| Compound Name | 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine |
| PubChem CID | 102052636 |
| Molecular Formula | C18H14FNO |
| Molecular Weight | 279.31 g/mol |
| Exact Mass | 279.11 |
| IUPAC Name | 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine |
| SMILES | COc1ccc(-c2c(F)cccc2-c2ccccn2)cc1 |
| InChI | InChI=1S/C18H14FNO/c1-21-14-10-8-13(9-11-14)18-15(5-4-6-16(18)19)17-7-2-3-12-20-17/h2-12H,1H3 |
| InChIKey | GMWPZIDUPUXHFD-UHFFFAOYSA-N |
| XLogP | 4.56 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 279.31 |
| LogP ≤ 5 | 4.56 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine?
The IUPAC name of 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine (CID 102052636) is 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine.
What is the SMILES notation for 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine?
The canonical SMILES for 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine is COc1ccc(-c2c(F)cccc2-c2ccccn2)cc1.
What is the InChIKey of 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine?
The InChIKey is GMWPZIDUPUXHFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FNO/c1-21-14-10-8-13(9-11-14)18-15(5-4-6-16(18)19)17-7-2-3-12-20-17/h2-12H,1H3.
What are the key properties of 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine?
2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine has a molecular weight of 279.31 g/mol, XLogP of 4.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-fluoro-2-(4-methoxyphenyl)phenyl]pyridine is sourced from PubChem (CID 102052636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).