About 4-fluoro-1-piperidin-3-ylpiperidine
4-fluoro-1-piperidin-3-ylpiperidine (PubChem CID 115017121) has the molecular formula C10H19FN2
and a molecular weight of 186.27 g/mol. Its IUPAC name is 4-fluoro-1-piperidin-3-ylpiperidine.
Molecular Properties
| Compound Name | 4-fluoro-1-piperidin-3-ylpiperidine |
| PubChem CID | 115017121 |
| Molecular Formula | C10H19FN2 |
| Molecular Weight | 186.27 g/mol |
| Exact Mass | 186.15 |
| IUPAC Name | 4-fluoro-1-piperidin-3-ylpiperidine |
| SMILES | FC1CCN(C2CCCNC2)CC1 |
| InChI | InChI=1S/C10H19FN2/c11-9-3-6-13(7-4-9)10-2-1-5-12-8-10/h9-10,12H,1-8H2 |
| InChIKey | WBNUJPYCDBFOER-UHFFFAOYSA-N |
| XLogP | 1.17 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 186.27 |
| LogP ≤ 5 | 1.17 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-fluoro-1-piperidin-3-ylpiperidine?
The IUPAC name of 4-fluoro-1-piperidin-3-ylpiperidine (CID 115017121) is 4-fluoro-1-piperidin-3-ylpiperidine.
What is the SMILES notation for 4-fluoro-1-piperidin-3-ylpiperidine?
The canonical SMILES for 4-fluoro-1-piperidin-3-ylpiperidine is FC1CCN(C2CCCNC2)CC1.
What is the InChIKey of 4-fluoro-1-piperidin-3-ylpiperidine?
The InChIKey is WBNUJPYCDBFOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2/c11-9-3-6-13(7-4-9)10-2-1-5-12-8-10/h9-10,12H,1-8H2.
What are the key properties of 4-fluoro-1-piperidin-3-ylpiperidine?
4-fluoro-1-piperidin-3-ylpiperidine has a molecular weight of 186.27 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-piperidin-3-ylpiperidine is sourced from PubChem (CID 115017121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).