About 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine
3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine (PubChem CID 143912807) has the molecular formula C16H17FN2O
and a molecular weight of 272.32 g/mol. Its IUPAC name is 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine.
Molecular Properties
| Compound Name | 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine |
| PubChem CID | 143912807 |
| Molecular Formula | C16H17FN2O |
| Molecular Weight | 272.32 g/mol |
| Exact Mass | 272.13 |
| IUPAC Name | 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine |
| SMILES | Fc1ccc(Oc2cncc(C3CCCCN3)c2)cc1 |
| InChI | InChI=1S/C16H17FN2O/c17-13-4-6-14(7-5-13)20-15-9-12(10-18-11-15)16-3-1-2-8-19-16/h4-7,9-11,16,19H,1-3,8H2 |
| InChIKey | XNHFUJYPAQEIAY-UHFFFAOYSA-N |
| XLogP | 3.83 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 272.32 |
| LogP ≤ 5 | 3.83 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine?
The IUPAC name of 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine (CID 143912807) is 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine.
What is the SMILES notation for 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine?
The canonical SMILES for 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine is Fc1ccc(Oc2cncc(C3CCCCN3)c2)cc1.
What is the InChIKey of 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine?
The InChIKey is XNHFUJYPAQEIAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c17-13-4-6-14(7-5-13)20-15-9-12(10-18-11-15)16-3-1-2-8-19-16/h4-7,9-11,16,19H,1-3,8H2.
What are the key properties of 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine?
3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine has a molecular weight of 272.32 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenoxy)-5-piperidin-2-ylpyridine is sourced from PubChem (CID 143912807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).