About [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol
[4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol (PubChem CID 103071362) has the molecular formula C10H20N2O2
and a molecular weight of 200.28 g/mol. Its IUPAC name is [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol.
Molecular Properties
| Compound Name | [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol |
| PubChem CID | 103071362 |
| Molecular Formula | C10H20N2O2 |
| Molecular Weight | 200.28 g/mol |
| Exact Mass | 200.15 |
| IUPAC Name | [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol |
| SMILES | C=C(CNC)CN1CCOCC1CO |
| InChI | InChI=1S/C10H20N2O2/c1-9(5-11-2)6-12-3-4-14-8-10(12)7-13/h10-11,13H,1,3-8H2,2H3 |
| InChIKey | GAQZUODWAXGIBM-UHFFFAOYSA-N |
| XLogP | -0.54 |
| TPSA | 44.73 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 200.28 |
| LogP ≤ 5 | -0.54 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol?
The IUPAC name of [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol (CID 103071362) is [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol.
What is the SMILES notation for [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol?
The canonical SMILES for [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol is C=C(CNC)CN1CCOCC1CO.
What is the InChIKey of [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol?
The InChIKey is GAQZUODWAXGIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9(5-11-2)6-12-3-4-14-8-10(12)7-13/h10-11,13H,1,3-8H2,2H3.
What are the key properties of [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol?
[4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol has a molecular weight of 200.28 g/mol, XLogP of -0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol is sourced from PubChem (CID 103071362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).