About 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide
4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide (PubChem CID 104751036) has the molecular formula C11H18N2O4
and a molecular weight of 242.27 g/mol. Its IUPAC name is 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide.
Molecular Properties
| Compound Name | 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide |
| PubChem CID | 104751036 |
| Molecular Formula | C11H18N2O4 |
| Molecular Weight | 242.27 g/mol |
| Exact Mass | 242.13 |
| IUPAC Name | 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide |
| SMILES | NC(=O)C1COCCN1CC(=O)C1CCOC1 |
| InChI | InChI=1S/C11H18N2O4/c12-11(15)9-7-17-4-2-13(9)5-10(14)8-1-3-16-6-8/h8-9H,1-7H2,(H2,12,15) |
| InChIKey | QJMIKYQIIWDFBZ-UHFFFAOYSA-N |
| XLogP | -1.22 |
| TPSA | 81.86 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 242.27 |
| LogP ≤ 5 | -1.22 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide?
The IUPAC name of 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide (CID 104751036) is 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide is NC(=O)C1COCCN1CC(=O)C1CCOC1.
What is the InChIKey of 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide?
The InChIKey is QJMIKYQIIWDFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4/c12-11(15)9-7-17-4-2-13(9)5-10(14)8-1-3-16-6-8/h8-9H,1-7H2,(H2,12,15).
What are the key properties of 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide?
4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide has a molecular weight of 242.27 g/mol, XLogP of -1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-oxo-2-(oxolan-3-yl)ethyl]morpholine-3-carboxamide is sourced from PubChem (CID 104751036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).