About 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine
3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine (PubChem CID 81459970) has the molecular formula C14H29N3
and a molecular weight of 239.41 g/mol. Its IUPAC name is 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine.
Molecular Properties
| Compound Name | 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine |
| PubChem CID | 81459970 |
| Molecular Formula | C14H29N3 |
| Molecular Weight | 239.41 g/mol |
| Exact Mass | 239.24 |
| IUPAC Name | 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine |
| SMILES | CCC1CN(CCN2CCCCC2)CCC1N |
| InChI | InChI=1S/C14H29N3/c1-2-13-12-17(9-6-14(13)15)11-10-16-7-4-3-5-8-16/h13-14H,2-12,15H2,1H3 |
| InChIKey | VPJLVJWYNBGETB-UHFFFAOYSA-N |
| XLogP | 1.53 |
| TPSA | 32.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 239.41 |
| LogP ≤ 5 | 1.53 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine?
The IUPAC name of 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine (CID 81459970) is 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine.
What is the SMILES notation for 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine?
The canonical SMILES for 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine is CCC1CN(CCN2CCCCC2)CCC1N.
What is the InChIKey of 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine?
The InChIKey is VPJLVJWYNBGETB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-2-13-12-17(9-6-14(13)15)11-10-16-7-4-3-5-8-16/h13-14H,2-12,15H2,1H3.
What are the key properties of 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine?
3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine has a molecular weight of 239.41 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine is sourced from PubChem (CID 81459970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).