About 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine
4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine (PubChem CID 62428370) has the molecular formula C15H31N3
and a molecular weight of 253.43 g/mol. Its IUPAC name is 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine.
Molecular Properties
| Compound Name | 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine |
| PubChem CID | 62428370 |
| Molecular Formula | C15H31N3 |
| Molecular Weight | 253.43 g/mol |
| Exact Mass | 253.25 |
| IUPAC Name | 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine |
| SMILES | CC(CCCN)N1CCC(N2CCCCC2)CC1 |
| InChI | InChI=1S/C15H31N3/c1-14(6-5-9-16)17-12-7-15(8-13-17)18-10-3-2-4-11-18/h14-15H,2-13,16H2,1H3 |
| InChIKey | ILEOSCAMPZLVRG-UHFFFAOYSA-N |
| XLogP | 2.06 |
| TPSA | 32.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 253.43 |
| LogP ≤ 5 | 2.06 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine?
The IUPAC name of 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine (CID 62428370) is 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine.
What is the SMILES notation for 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine?
The canonical SMILES for 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine is CC(CCCN)N1CCC(N2CCCCC2)CC1.
What is the InChIKey of 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine?
The InChIKey is ILEOSCAMPZLVRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-14(6-5-9-16)17-12-7-15(8-13-17)18-10-3-2-4-11-18/h14-15H,2-13,16H2,1H3.
What are the key properties of 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine?
4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine has a molecular weight of 253.43 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-piperidin-1-ylpiperidin-1-yl)pentan-1-amine is sourced from PubChem (CID 62428370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).