About 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine
2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine (PubChem CID 103175011) has the molecular formula C14H27NO2
and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine.
Molecular Properties
| Compound Name | 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine |
| PubChem CID | 103175011 |
| Molecular Formula | C14H27NO2 |
| Molecular Weight | 241.37 g/mol |
| Exact Mass | 241.20 |
| IUPAC Name | 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine |
| SMILES | CCC1NC(C)CCC1OCC1CCOCC1 |
| InChI | InChI=1S/C14H27NO2/c1-3-13-14(5-4-11(2)15-13)17-10-12-6-8-16-9-7-12/h11-15H,3-10H2,1-2H3 |
| InChIKey | UZBVAYGOGHEESE-UHFFFAOYSA-N |
| XLogP | 2.35 |
| TPSA | 30.49 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 241.37 |
| LogP ≤ 5 | 2.35 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine?
The IUPAC name of 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine (CID 103175011) is 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine.
What is the SMILES notation for 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine?
The canonical SMILES for 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine is CCC1NC(C)CCC1OCC1CCOCC1.
What is the InChIKey of 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine?
The InChIKey is UZBVAYGOGHEESE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-3-13-14(5-4-11(2)15-13)17-10-12-6-8-16-9-7-12/h11-15H,3-10H2,1-2H3.
What are the key properties of 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine?
2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine has a molecular weight of 241.37 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-methyl-3-(oxan-4-ylmethoxy)piperidine is sourced from PubChem (CID 103175011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).