About N-hex-5-en-2-ylpiperidin-1-amine
N-hex-5-en-2-ylpiperidin-1-amine (PubChem CID 104655846) has the molecular formula C11H22N2
and a molecular weight of 182.31 g/mol. Its IUPAC name is N-hex-5-en-2-ylpiperidin-1-amine.
Molecular Properties
| Compound Name | N-hex-5-en-2-ylpiperidin-1-amine |
| PubChem CID | 104655846 |
| Molecular Formula | C11H22N2 |
| Molecular Weight | 182.31 g/mol |
| Exact Mass | 182.18 |
| IUPAC Name | N-hex-5-en-2-ylpiperidin-1-amine |
| SMILES | C=CCCC(C)NN1CCCCC1 |
| InChI | InChI=1S/C11H22N2/c1-3-4-8-11(2)12-13-9-6-5-7-10-13/h3,11-12H,1,4-10H2,2H3 |
| InChIKey | DUMMNIDUIKYIHS-UHFFFAOYSA-N |
| XLogP | 2.33 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 182.31 |
| LogP ≤ 5 | 2.33 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-hex-5-en-2-ylpiperidin-1-amine?
The IUPAC name of N-hex-5-en-2-ylpiperidin-1-amine (CID 104655846) is N-hex-5-en-2-ylpiperidin-1-amine.
What is the SMILES notation for N-hex-5-en-2-ylpiperidin-1-amine?
The canonical SMILES for N-hex-5-en-2-ylpiperidin-1-amine is C=CCCC(C)NN1CCCCC1.
What is the InChIKey of N-hex-5-en-2-ylpiperidin-1-amine?
The InChIKey is DUMMNIDUIKYIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-3-4-8-11(2)12-13-9-6-5-7-10-13/h3,11-12H,1,4-10H2,2H3.
What are the key properties of N-hex-5-en-2-ylpiperidin-1-amine?
N-hex-5-en-2-ylpiperidin-1-amine has a molecular weight of 182.31 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hex-5-en-2-ylpiperidin-1-amine is sourced from PubChem (CID 104655846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).