About 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium
2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium (PubChem CID 7219875) has the molecular formula C7H16NO2+
and a molecular weight of 146.21 g/mol. Its IUPAC name is 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium.
Molecular Properties
| Compound Name | 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium |
| PubChem CID | 7219875 |
| Molecular Formula | C7H16NO2+ |
| Molecular Weight | 146.21 g/mol |
| Exact Mass | 146.12 |
| IUPAC Name | 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium |
| SMILES | [NH3+]CCOC[C@H]1CCCO1 |
| InChI | InChI=1S/C7H15NO2/c8-3-5-9-6-7-2-1-4-10-7/h7H,1-6,8H2/p+1/t7-/m1/s1 |
| InChIKey | VGFPQGITBRBQAN-SSDOTTSWSA-O |
| XLogP | -0.58 |
| TPSA | 46.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 146.21 |
| LogP ≤ 5 | -0.58 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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-[[(2R)-oxolan-2-yl]methoxy]ethylazanium?
The IUPAC name of 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium (CID 7219875) is 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium.
What is the SMILES notation for 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium?
The canonical SMILES for 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium is [NH3+]CCOC[C@H]1CCCO1.
What is the InChIKey of 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium?
The InChIKey is VGFPQGITBRBQAN-SSDOTTSWSA-O. The full InChI is InChI=1S/C7H15NO2/c8-3-5-9-6-7-2-1-4-10-7/h7H,1-6,8H2/p+1/t7-/m1/s1.
What are the key properties of 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium?
2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium has a molecular weight of 146.21 g/mol, XLogP of -0.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium is sourced from PubChem (CID 7219875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).