About 5-ethyl-3-azaspiro[5.7]tridecane
5-ethyl-3-azaspiro[5.7]tridecane (PubChem CID 79321134) has the molecular formula C14H27N
and a molecular weight of 209.38 g/mol. Its IUPAC name is 5-ethyl-3-azaspiro[5.7]tridecane.
Molecular Properties
| Compound Name | 5-ethyl-3-azaspiro[5.7]tridecane |
| PubChem CID | 79321134 |
| Molecular Formula | C14H27N |
| Molecular Weight | 209.38 g/mol |
| Exact Mass | 209.21 |
| IUPAC Name | 5-ethyl-3-azaspiro[5.7]tridecane |
| SMILES | CCC1CNCCC12CCCCCCC2 |
| InChI | InChI=1S/C14H27N/c1-2-13-12-15-11-10-14(13)8-6-4-3-5-7-9-14/h13,15H,2-12H2,1H3 |
| InChIKey | PANCUEJLQDOOGO-UHFFFAOYSA-N |
| XLogP | 3.74 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.38 |
| LogP ≤ 5 | 3.74 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 5-ethyl-3-azaspiro[5.7]tridecane?
The IUPAC name of 5-ethyl-3-azaspiro[5.7]tridecane (CID 79321134) is 5-ethyl-3-azaspiro[5.7]tridecane.
What is the SMILES notation for 5-ethyl-3-azaspiro[5.7]tridecane?
The canonical SMILES for 5-ethyl-3-azaspiro[5.7]tridecane is CCC1CNCCC12CCCCCCC2.
What is the InChIKey of 5-ethyl-3-azaspiro[5.7]tridecane?
The InChIKey is PANCUEJLQDOOGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-2-13-12-15-11-10-14(13)8-6-4-3-5-7-9-14/h13,15H,2-12H2,1H3.
What are the key properties of 5-ethyl-3-azaspiro[5.7]tridecane?
5-ethyl-3-azaspiro[5.7]tridecane has a molecular weight of 209.38 g/mol, XLogP of 3.74, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-azaspiro[5.7]tridecane is sourced from PubChem (CID 79321134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).