About 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine
4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine (PubChem CID 79183128) has the molecular formula C14H28N2O2
and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine.
Molecular Properties
| Compound Name | 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine |
| PubChem CID | 79183128 |
| Molecular Formula | C14H28N2O2 |
| Molecular Weight | 256.39 g/mol |
| Exact Mass | 256.22 |
| IUPAC Name | 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine |
| SMILES | CCN1CCOC(COCCC2CCCNC2)C1 |
| InChI | InChI=1S/C14H28N2O2/c1-2-16-7-9-18-14(11-16)12-17-8-5-13-4-3-6-15-10-13/h13-15H,2-12H2,1H3 |
| InChIKey | JKSDUQOEUIRYQV-UHFFFAOYSA-N |
| XLogP | 1.11 |
| TPSA | 33.73 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.39 |
| LogP ≤ 5 | 1.11 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine?
The IUPAC name of 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine (CID 79183128) is 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine.
What is the SMILES notation for 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine?
The canonical SMILES for 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine is CCN1CCOC(COCCC2CCCNC2)C1.
What is the InChIKey of 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine?
The InChIKey is JKSDUQOEUIRYQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-2-16-7-9-18-14(11-16)12-17-8-5-13-4-3-6-15-10-13/h13-15H,2-12H2,1H3.
What are the key properties of 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine?
4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine has a molecular weight of 256.39 g/mol, XLogP of 1.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(2-piperidin-3-ylethoxymethyl)morpholine is sourced from PubChem (CID 79183128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).