About 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one
7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one (PubChem CID 54537516) has the molecular formula C10H17NO2
and a molecular weight of 183.25 g/mol. Its IUPAC name is 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one.
Molecular Properties
| Compound Name | 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one |
| PubChem CID | 54537516 |
| Molecular Formula | C10H17NO2 |
| Molecular Weight | 183.25 g/mol |
| Exact Mass | 183.13 |
| IUPAC Name | 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one |
| SMILES | CN1C(=O)CC2(CCCC2)CC1O |
| InChI | InChI=1S/C10H17NO2/c1-11-8(12)6-10(7-9(11)13)4-2-3-5-10/h8,12H,2-7H2,1H3 |
| InChIKey | ZAVKQEIZMRGUQE-UHFFFAOYSA-N |
| XLogP | 1.12 |
| TPSA | 40.54 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 183.25 |
| LogP ≤ 5 | 1.12 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one?
The IUPAC name of 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one (CID 54537516) is 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one.
What is the SMILES notation for 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one?
The canonical SMILES for 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one is CN1C(=O)CC2(CCCC2)CC1O.
What is the InChIKey of 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one?
The InChIKey is ZAVKQEIZMRGUQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-11-8(12)6-10(7-9(11)13)4-2-3-5-10/h8,12H,2-7H2,1H3.
What are the key properties of 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one?
7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one has a molecular weight of 183.25 g/mol, XLogP of 1.12, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-8-methyl-8-azaspiro[4.5]decan-9-one is sourced from PubChem (CID 54537516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).