About 4-[(2-fluorophenyl)methyl]pyridine
4-[(2-fluorophenyl)methyl]pyridine (PubChem CID 23294432) has the molecular formula C12H10FN
and a molecular weight of 187.22 g/mol. Its IUPAC name is 4-[(2-fluorophenyl)methyl]pyridine.
Molecular Properties
| Compound Name | 4-[(2-fluorophenyl)methyl]pyridine |
| PubChem CID | 23294432 |
| Molecular Formula | C12H10FN |
| Molecular Weight | 187.22 g/mol |
| Exact Mass | 187.08 |
| IUPAC Name | 4-[(2-fluorophenyl)methyl]pyridine |
| SMILES | Fc1ccccc1Cc1ccncc1 |
| InChI | InChI=1S/C12H10FN/c13-12-4-2-1-3-11(12)9-10-5-7-14-8-6-10/h1-8H,9H2 |
| InChIKey | WYJKEFXVVDVHMB-UHFFFAOYSA-N |
| XLogP | 2.81 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 187.22 |
| LogP ≤ 5 | 2.81 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-[(2-fluorophenyl)methyl]pyridine?
The IUPAC name of 4-[(2-fluorophenyl)methyl]pyridine (CID 23294432) is 4-[(2-fluorophenyl)methyl]pyridine.
What is the SMILES notation for 4-[(2-fluorophenyl)methyl]pyridine?
The canonical SMILES for 4-[(2-fluorophenyl)methyl]pyridine is Fc1ccccc1Cc1ccncc1.
What is the InChIKey of 4-[(2-fluorophenyl)methyl]pyridine?
The InChIKey is WYJKEFXVVDVHMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN/c13-12-4-2-1-3-11(12)9-10-5-7-14-8-6-10/h1-8H,9H2.
What are the key properties of 4-[(2-fluorophenyl)methyl]pyridine?
4-[(2-fluorophenyl)methyl]pyridine has a molecular weight of 187.22 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-fluorophenyl)methyl]pyridine is sourced from PubChem (CID 23294432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).