About 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine
1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine (PubChem CID 115074072) has the molecular formula C13H26N2
and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine.
Molecular Properties
| Compound Name | 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine |
| PubChem CID | 115074072 |
| Molecular Formula | C13H26N2 |
| Molecular Weight | 210.36 g/mol |
| Exact Mass | 210.21 |
| IUPAC Name | 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine |
| SMILES | CCN1CCCC(C2(N)CCCCC2)C1 |
| InChI | InChI=1S/C13H26N2/c1-2-15-10-6-7-12(11-15)13(14)8-4-3-5-9-13/h12H,2-11,14H2,1H3 |
| InChIKey | KUAAJSXICOXSCZ-UHFFFAOYSA-N |
| XLogP | 2.38 |
| TPSA | 29.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 210.36 |
| LogP ≤ 5 | 2.38 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine?
The IUPAC name of 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine (CID 115074072) is 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine.
What is the SMILES notation for 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine?
The canonical SMILES for 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine is CCN1CCCC(C2(N)CCCCC2)C1.
What is the InChIKey of 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine?
The InChIKey is KUAAJSXICOXSCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-15-10-6-7-12(11-15)13(14)8-4-3-5-9-13/h12H,2-11,14H2,1H3.
What are the key properties of 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine?
1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpiperidin-3-yl)cyclohexan-1-amine is sourced from PubChem (CID 115074072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).