About 8-phenyl-2-azaspiro[4.5]decan-3-one
8-phenyl-2-azaspiro[4.5]decan-3-one (PubChem CID 10489597) has the molecular formula C15H19NO
and a molecular weight of 229.32 g/mol. Its IUPAC name is 8-phenyl-2-azaspiro[4.5]decan-3-one.
Molecular Properties
| Compound Name | 8-phenyl-2-azaspiro[4.5]decan-3-one |
| PubChem CID | 10489597 |
| Molecular Formula | C15H19NO |
| Molecular Weight | 229.32 g/mol |
| Exact Mass | 229.15 |
| IUPAC Name | 8-phenyl-2-azaspiro[4.5]decan-3-one |
| SMILES | O=C1CC2(CCC(c3ccccc3)CC2)CN1 |
| InChI | InChI=1S/C15H19NO/c17-14-10-15(11-16-14)8-6-13(7-9-15)12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H,16,17) |
| InChIKey | OEKIBTILRILZER-UHFFFAOYSA-N |
| XLogP | 2.85 |
| TPSA | 29.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 229.32 |
| LogP ≤ 5 | 2.85 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 8-phenyl-2-azaspiro[4.5]decan-3-one?
The IUPAC name of 8-phenyl-2-azaspiro[4.5]decan-3-one (CID 10489597) is 8-phenyl-2-azaspiro[4.5]decan-3-one.
What is the SMILES notation for 8-phenyl-2-azaspiro[4.5]decan-3-one?
The canonical SMILES for 8-phenyl-2-azaspiro[4.5]decan-3-one is O=C1CC2(CCC(c3ccccc3)CC2)CN1.
What is the InChIKey of 8-phenyl-2-azaspiro[4.5]decan-3-one?
The InChIKey is OEKIBTILRILZER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c17-14-10-15(11-16-14)8-6-13(7-9-15)12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H,16,17).
What are the key properties of 8-phenyl-2-azaspiro[4.5]decan-3-one?
8-phenyl-2-azaspiro[4.5]decan-3-one has a molecular weight of 229.32 g/mol, XLogP of 2.85, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-phenyl-2-azaspiro[4.5]decan-3-one is sourced from PubChem (CID 10489597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).