About 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine
2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine (PubChem CID 115313242) has the molecular formula C14H26N2O
and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine.
Molecular Properties
| Compound Name | 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine |
| PubChem CID | 115313242 |
| Molecular Formula | C14H26N2O |
| Molecular Weight | 238.37 g/mol |
| Exact Mass | 238.20 |
| IUPAC Name | 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine |
| SMILES | CC1CC(N)CCN1C1CCOC2(CCC2)C1 |
| InChI | InChI=1S/C14H26N2O/c1-11-9-12(15)3-7-16(11)13-4-8-17-14(10-13)5-2-6-14/h11-13H,2-10,15H2,1H3 |
| InChIKey | TWAXLYLPEUVSTA-UHFFFAOYSA-N |
| XLogP | 1.90 |
| TPSA | 38.49 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 238.37 |
| LogP ≤ 5 | 1.90 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine?
The IUPAC name of 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine (CID 115313242) is 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine.
What is the SMILES notation for 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine?
The canonical SMILES for 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine is CC1CC(N)CCN1C1CCOC2(CCC2)C1.
What is the InChIKey of 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine?
The InChIKey is TWAXLYLPEUVSTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-11-9-12(15)3-7-16(11)13-4-8-17-14(10-13)5-2-6-14/h11-13H,2-10,15H2,1H3.
What are the key properties of 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine?
2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine has a molecular weight of 238.37 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-amine is sourced from PubChem (CID 115313242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).