About 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone
1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone (PubChem CID 130643020) has the molecular formula C10H17NO2
and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone.
Molecular Properties
| Compound Name | 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone |
| PubChem CID | 130643020 |
| Molecular Formula | C10H17NO2 |
| Molecular Weight | 183.25 g/mol |
| Exact Mass | 183.13 |
| IUPAC Name | 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone |
| SMILES | O=C(CO)N1CCCC2(CCC2)C1 |
| InChI | InChI=1S/C10H17NO2/c12-7-9(13)11-6-2-5-10(8-11)3-1-4-10/h12H,1-8H2 |
| InChIKey | HJHYMJQELBKEFL-UHFFFAOYSA-N |
| XLogP | 0.77 |
| TPSA | 40.54 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 183.25 |
| LogP ≤ 5 | 0.77 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone?
The IUPAC name of 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone (CID 130643020) is 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone.
What is the SMILES notation for 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone?
The canonical SMILES for 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone is O=C(CO)N1CCCC2(CCC2)C1.
What is the InChIKey of 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone?
The InChIKey is HJHYMJQELBKEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c12-7-9(13)11-6-2-5-10(8-11)3-1-4-10/h12H,1-8H2.
What are the key properties of 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone?
1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone has a molecular weight of 183.25 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-azaspiro[3.5]nonan-6-yl)-2-hydroxyethanone is sourced from PubChem (CID 130643020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).