About 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine
3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine (PubChem CID 65170115) has the molecular formula C15H29NO2
and a molecular weight of 255.40 g/mol. Its IUPAC name is 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine.
Molecular Properties
| Compound Name | 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine |
| PubChem CID | 65170115 |
| Molecular Formula | C15H29NO2 |
| Molecular Weight | 255.40 g/mol |
| Exact Mass | 255.22 |
| IUPAC Name | 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine |
| SMILES | CCOC1CC(NC(C)COC)C12CCCCC2 |
| InChI | InChI=1S/C15H29NO2/c1-4-18-14-10-13(16-12(2)11-17-3)15(14)8-6-5-7-9-15/h12-14,16H,4-11H2,1-3H3 |
| InChIKey | XBJOURLRVWUZLI-UHFFFAOYSA-N |
| XLogP | 2.74 |
| TPSA | 30.49 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 255.40 |
| LogP ≤ 5 | 2.74 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine?
The IUPAC name of 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine (CID 65170115) is 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine.
What is the SMILES notation for 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine?
The canonical SMILES for 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine is CCOC1CC(NC(C)COC)C12CCCCC2.
What is the InChIKey of 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine?
The InChIKey is XBJOURLRVWUZLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-4-18-14-10-13(16-12(2)11-17-3)15(14)8-6-5-7-9-15/h12-14,16H,4-11H2,1-3H3.
What are the key properties of 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine?
3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine has a molecular weight of 255.40 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(1-methoxypropan-2-yl)spiro[3.5]nonan-1-amine is sourced from PubChem (CID 65170115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).