About 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol
2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol (PubChem CID 102934999) has the molecular formula C10H21NO4
and a molecular weight of 219.28 g/mol. Its IUPAC name is 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol.
Molecular Properties
| Compound Name | 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol |
| PubChem CID | 102934999 |
| Molecular Formula | C10H21NO4 |
| Molecular Weight | 219.28 g/mol |
| Exact Mass | 219.15 |
| IUPAC Name | 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol |
| SMILES | CC1CN(CCOCCO)CC(CO)O1 |
| InChI | InChI=1S/C10H21NO4/c1-9-6-11(2-4-14-5-3-12)7-10(8-13)15-9/h9-10,12-13H,2-8H2,1H3 |
| InChIKey | XIWSGCYMSXYCQW-UHFFFAOYSA-N |
| XLogP | -0.92 |
| TPSA | 62.16 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 219.28 |
| LogP ≤ 5 | -0.92 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol (CID 102934999) is 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol is CC1CN(CCOCCO)CC(CO)O1.
What is the InChIKey of 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol?
The InChIKey is XIWSGCYMSXYCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO4/c1-9-6-11(2-4-14-5-3-12)7-10(8-13)15-9/h9-10,12-13H,2-8H2,1H3.
What are the key properties of 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol?
2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol has a molecular weight of 219.28 g/mol, XLogP of -0.92, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol is sourced from PubChem (CID 102934999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).