About 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone
2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone (PubChem CID 114468321) has the molecular formula C11H20N2O3
and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone.
Molecular Properties
| Compound Name | 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone |
| PubChem CID | 114468321 |
| Molecular Formula | C11H20N2O3 |
| Molecular Weight | 228.29 g/mol |
| Exact Mass | 228.15 |
| IUPAC Name | 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone |
| SMILES | O=C(COCC1CNCCO1)N1CCCC1 |
| InChI | InChI=1S/C11H20N2O3/c14-11(13-4-1-2-5-13)9-15-8-10-7-12-3-6-16-10/h10,12H,1-9H2 |
| InChIKey | TWKLKPRGRBYUQB-UHFFFAOYSA-N |
| XLogP | -0.39 |
| TPSA | 50.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 228.29 |
| LogP ≤ 5 | -0.39 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone?
The IUPAC name of 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone (CID 114468321) is 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone.
What is the SMILES notation for 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone?
The canonical SMILES for 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone is O=C(COCC1CNCCO1)N1CCCC1.
What is the InChIKey of 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone?
The InChIKey is TWKLKPRGRBYUQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c14-11(13-4-1-2-5-13)9-15-8-10-7-12-3-6-16-10/h10,12H,1-9H2.
What are the key properties of 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone?
2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone has a molecular weight of 228.29 g/mol, XLogP of -0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholin-2-ylmethoxy)-1-pyrrolidin-1-ylethanone is sourced from PubChem (CID 114468321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).