About 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine
4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine (PubChem CID 71638034) has the molecular formula C13H21NO2
and a molecular weight of 223.32 g/mol. Its IUPAC name is 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine.
Molecular Properties
| Compound Name | 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine |
| PubChem CID | 71638034 |
| Molecular Formula | C13H21NO2 |
| Molecular Weight | 223.32 g/mol |
| Exact Mass | 223.16 |
| IUPAC Name | 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine |
| SMILES | CC(OCCC1CCNCC1)c1ccco1 |
| InChI | InChI=1S/C13H21NO2/c1-11(13-3-2-9-16-13)15-10-6-12-4-7-14-8-5-12/h2-3,9,11-12,14H,4-8,10H2,1H3 |
| InChIKey | IXDVMKHFJJKRLI-UHFFFAOYSA-N |
| XLogP | 2.75 |
| TPSA | 34.40 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 223.32 |
| LogP ≤ 5 | 2.75 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine?
The IUPAC name of 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine (CID 71638034) is 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine.
What is the SMILES notation for 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine?
The canonical SMILES for 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine is CC(OCCC1CCNCC1)c1ccco1.
What is the InChIKey of 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine?
The InChIKey is IXDVMKHFJJKRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-11(13-3-2-9-16-13)15-10-6-12-4-7-14-8-5-12/h2-3,9,11-12,14H,4-8,10H2,1H3.
What are the key properties of 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine?
4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine has a molecular weight of 223.32 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-(furan-2-yl)ethoxy]ethyl]piperidine is sourced from PubChem (CID 71638034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).