About 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol
7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol (PubChem CID 59426567) has the molecular formula C15H27NO2
and a molecular weight of 253.39 g/mol. Its IUPAC name is 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol.
Molecular Properties
| Compound Name | 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol |
| PubChem CID | 59426567 |
| Molecular Formula | C15H27NO2 |
| Molecular Weight | 253.39 g/mol |
| Exact Mass | 253.20 |
| IUPAC Name | 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol |
| SMILES | OC1CC2(CCCCC2)N(O)C2(CCCCC2)C1 |
| InChI | InChI=1S/C15H27NO2/c17-13-11-14(7-3-1-4-8-14)16(18)15(12-13)9-5-2-6-10-15/h13,17-18H,1-12H2 |
| InChIKey | URSLMPCNTKILMX-UHFFFAOYSA-N |
| XLogP | 3.24 |
| TPSA | 43.70 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 253.39 |
| LogP ≤ 5 | 3.24 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol?
The IUPAC name of 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol (CID 59426567) is 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol.
What is the SMILES notation for 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol?
The canonical SMILES for 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol is OC1CC2(CCCCC2)N(O)C2(CCCCC2)C1.
What is the InChIKey of 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol?
The InChIKey is URSLMPCNTKILMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c17-13-11-14(7-3-1-4-8-14)16(18)15(12-13)9-5-2-6-10-15/h13,17-18H,1-12H2.
What are the key properties of 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol?
7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol has a molecular weight of 253.39 g/mol, XLogP of 3.24, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-7-azadispiro[5.1.58.36]hexadecan-15-ol is sourced from PubChem (CID 59426567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).