About N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide
N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide (PubChem CID 102935999) has the molecular formula C11H22N2O3
and a molecular weight of 230.31 g/mol. Its IUPAC name is N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide.
Molecular Properties
| Compound Name | N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide |
| PubChem CID | 102935999 |
| Molecular Formula | C11H22N2O3 |
| Molecular Weight | 230.31 g/mol |
| Exact Mass | 230.16 |
| IUPAC Name | N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide |
| SMILES | CCN(C)C(=O)CN1CC(C)OC(CO)C1 |
| InChI | InChI=1S/C11H22N2O3/c1-4-12(3)11(15)7-13-5-9(2)16-10(6-13)8-14/h9-10,14H,4-8H2,1-3H3 |
| InChIKey | OMRLYESFOSSURO-UHFFFAOYSA-N |
| XLogP | -0.45 |
| TPSA | 53.01 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 | 230.31 |
| LogP ≤ 5 | -0.45 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide?
The IUPAC name of N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide (CID 102935999) is N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide.
What is the SMILES notation for N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide?
The canonical SMILES for N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide is CCN(C)C(=O)CN1CC(C)OC(CO)C1.
What is the InChIKey of N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide?
The InChIKey is OMRLYESFOSSURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-4-12(3)11(15)7-13-5-9(2)16-10(6-13)8-14/h9-10,14H,4-8H2,1-3H3.
What are the key properties of N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide?
N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide has a molecular weight of 230.31 g/mol, XLogP of -0.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methylacetamide is sourced from PubChem (CID 102935999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).