About 1-[2-(fluoromethoxy)ethyl]piperidine
1-[2-(fluoromethoxy)ethyl]piperidine (PubChem CID 144926312) has the molecular formula C8H16FNO
and a molecular weight of 161.22 g/mol. Its IUPAC name is 1-[2-(fluoromethoxy)ethyl]piperidine.
Molecular Properties
| Compound Name | 1-[2-(fluoromethoxy)ethyl]piperidine |
| PubChem CID | 144926312 |
| Molecular Formula | C8H16FNO |
| Molecular Weight | 161.22 g/mol |
| Exact Mass | 161.12 |
| IUPAC Name | 1-[2-(fluoromethoxy)ethyl]piperidine |
| SMILES | FCOCCN1CCCCC1 |
| InChI | InChI=1S/C8H16FNO/c9-8-11-7-6-10-4-2-1-3-5-10/h1-8H2 |
| InChIKey | XMDLIBGWVHCBGO-UHFFFAOYSA-N |
| XLogP | 1.42 |
| TPSA | 12.47 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 161.22 |
| LogP ≤ 5 | 1.42 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-[2-(fluoromethoxy)ethyl]piperidine?
The IUPAC name of 1-[2-(fluoromethoxy)ethyl]piperidine (CID 144926312) is 1-[2-(fluoromethoxy)ethyl]piperidine.
What is the SMILES notation for 1-[2-(fluoromethoxy)ethyl]piperidine?
The canonical SMILES for 1-[2-(fluoromethoxy)ethyl]piperidine is FCOCCN1CCCCC1.
What is the InChIKey of 1-[2-(fluoromethoxy)ethyl]piperidine?
The InChIKey is XMDLIBGWVHCBGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c9-8-11-7-6-10-4-2-1-3-5-10/h1-8H2.
What are the key properties of 1-[2-(fluoromethoxy)ethyl]piperidine?
1-[2-(fluoromethoxy)ethyl]piperidine has a molecular weight of 161.22 g/mol, XLogP of 1.42, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(fluoromethoxy)ethyl]piperidine is sourced from PubChem (CID 144926312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).