About 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol
2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol (PubChem CID 168990013) has the molecular formula C8H15NO2
and a molecular weight of 157.21 g/mol. Its IUPAC name is 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol.
Molecular Properties
| Compound Name | 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol |
| PubChem CID | 168990013 |
| Molecular Formula | C8H15NO2 |
| Molecular Weight | 157.21 g/mol |
| Exact Mass | 157.11 |
| IUPAC Name | 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol |
| SMILES | OCCN1CCCC12COC2 |
| InChI | InChI=1S/C8H15NO2/c10-5-4-9-3-1-2-8(9)6-11-7-8/h10H,1-7H2 |
| InChIKey | NOQHTRWTZFCFQV-UHFFFAOYSA-N |
| XLogP | -0.16 |
| TPSA | 32.70 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 157.21 |
| LogP ≤ 5 | -0.16 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol?
The IUPAC name of 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol (CID 168990013) is 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol.
What is the SMILES notation for 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol?
The canonical SMILES for 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol is OCCN1CCCC12COC2.
What is the InChIKey of 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol?
The InChIKey is NOQHTRWTZFCFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c10-5-4-9-3-1-2-8(9)6-11-7-8/h10H,1-7H2.
What are the key properties of 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol?
2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol has a molecular weight of 157.21 g/mol, XLogP of -0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxa-5-azaspiro[3.4]octan-5-yl)ethanol is sourced from PubChem (CID 168990013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).