About O-ethylhydroxylamine;trimethyl(propyl)azanium
O-ethylhydroxylamine;trimethyl(propyl)azanium (PubChem CID 162168540) has the molecular formula C8H23N2O+
and a molecular weight of 163.28 g/mol. Its IUPAC name is O-ethylhydroxylamine;trimethyl(propyl)azanium.
Molecular Properties
| Compound Name | O-ethylhydroxylamine;trimethyl(propyl)azanium |
| PubChem CID | 162168540 |
| Molecular Formula | C8H23N2O+ |
| Molecular Weight | 163.28 g/mol |
| Exact Mass | 163.18 |
| IUPAC Name | O-ethylhydroxylamine;trimethyl(propyl)azanium |
| SMILES | CCC[N+](C)(C)C.CCON |
| InChI | InChI=1S/C6H16N.C2H7NO/c1-5-6-7(2,3)4;1-2-4-3/h5-6H2,1-4H3;2-3H2,1H3/q+1; |
| InChIKey | VXWHDGIWWCOVFJ-UHFFFAOYSA-N |
| XLogP | 1.00 |
| TPSA | 35.25 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 163.28 |
| LogP ≤ 5 | 1.00 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of O-ethylhydroxylamine;trimethyl(propyl)azanium?
The IUPAC name of O-ethylhydroxylamine;trimethyl(propyl)azanium (CID 162168540) is O-ethylhydroxylamine;trimethyl(propyl)azanium.
What is the SMILES notation for O-ethylhydroxylamine;trimethyl(propyl)azanium?
The canonical SMILES for O-ethylhydroxylamine;trimethyl(propyl)azanium is CCC[N+](C)(C)C.CCON.
What is the InChIKey of O-ethylhydroxylamine;trimethyl(propyl)azanium?
The InChIKey is VXWHDGIWWCOVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N.C2H7NO/c1-5-6-7(2,3)4;1-2-4-3/h5-6H2,1-4H3;2-3H2,1H3/q+1;.
What are the key properties of O-ethylhydroxylamine;trimethyl(propyl)azanium?
O-ethylhydroxylamine;trimethyl(propyl)azanium has a molecular weight of 163.28 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-ethylhydroxylamine;trimethyl(propyl)azanium is sourced from PubChem (CID 162168540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).