About 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine
1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine (PubChem CID 63925487) has the molecular formula C15H32N2
and a molecular weight of 240.43 g/mol. Its IUPAC name is 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine.
Molecular Properties
| Compound Name | 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine |
| PubChem CID | 63925487 |
| Molecular Formula | C15H32N2 |
| Molecular Weight | 240.43 g/mol |
| Exact Mass | 240.26 |
| IUPAC Name | 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine |
| SMILES | CCCNC1CCN(C(C)CCC(C)C)CC1 |
| InChI | InChI=1S/C15H32N2/c1-5-10-16-15-8-11-17(12-9-15)14(4)7-6-13(2)3/h13-16H,5-12H2,1-4H3 |
| InChIKey | HELIAJCLEHMFEM-UHFFFAOYSA-N |
| XLogP | 3.28 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 240.43 |
| LogP ≤ 5 | 3.28 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine?
The IUPAC name of 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine (CID 63925487) is 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine?
The canonical SMILES for 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine is CCCNC1CCN(C(C)CCC(C)C)CC1.
What is the InChIKey of 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine?
The InChIKey is HELIAJCLEHMFEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-5-10-16-15-8-11-17(12-9-15)14(4)7-6-13(2)3/h13-16H,5-12H2,1-4H3.
What are the key properties of 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine?
1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine has a molecular weight of 240.43 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylhexan-2-yl)-N-propylpiperidin-4-amine is sourced from PubChem (CID 63925487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).