About 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine
4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine (PubChem CID 102952549) has the molecular formula C15H28N2
and a molecular weight of 236.40 g/mol. Its IUPAC name is 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine.
Molecular Properties
| Compound Name | 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine |
| PubChem CID | 102952549 |
| Molecular Formula | C15H28N2 |
| Molecular Weight | 236.40 g/mol |
| Exact Mass | 236.23 |
| IUPAC Name | 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine |
| SMILES | CC1CCN(C2CCC23CCCCC3)CC1N |
| InChI | InChI=1S/C15H28N2/c1-12-6-10-17(11-13(12)16)14-5-9-15(14)7-3-2-4-8-15/h12-14H,2-11,16H2,1H3 |
| InChIKey | QZEJLMYQBKVQFN-UHFFFAOYSA-N |
| XLogP | 2.77 |
| TPSA | 29.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.40 |
| LogP ≤ 5 | 2.77 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine?
The IUPAC name of 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine (CID 102952549) is 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine.
What is the SMILES notation for 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine?
The canonical SMILES for 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine is CC1CCN(C2CCC23CCCCC3)CC1N.
What is the InChIKey of 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine?
The InChIKey is QZEJLMYQBKVQFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-12-6-10-17(11-13(12)16)14-5-9-15(14)7-3-2-4-8-15/h12-14H,2-11,16H2,1H3.
What are the key properties of 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine?
4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine has a molecular weight of 236.40 g/mol, XLogP of 2.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-spiro[3.5]nonan-3-ylpiperidin-3-amine is sourced from PubChem (CID 102952549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).