About 1-hydroxypiperidin-4-amine
1-hydroxypiperidin-4-amine (PubChem CID 56972720) has the molecular formula C5H12N2O
and a molecular weight of 116.16 g/mol. Its IUPAC name is 1-hydroxypiperidin-4-amine.
Molecular Properties
| Compound Name | 1-hydroxypiperidin-4-amine |
| PubChem CID | 56972720 |
| Molecular Formula | C5H12N2O |
| Molecular Weight | 116.16 g/mol |
| Exact Mass | 116.09 |
| IUPAC Name | 1-hydroxypiperidin-4-amine |
| SMILES | NC1CCN(O)CC1 |
| InChI | InChI=1S/C5H12N2O/c6-5-1-3-7(8)4-2-5/h5,8H,1-4,6H2 |
| InChIKey | QTCJNHGVKMBNNN-UHFFFAOYSA-N |
| XLogP | -0.20 |
| TPSA | 49.49 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 116.16 |
| LogP ≤ 5 | -0.20 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-hydroxypiperidin-4-amine?
The IUPAC name of 1-hydroxypiperidin-4-amine (CID 56972720) is 1-hydroxypiperidin-4-amine.
What is the SMILES notation for 1-hydroxypiperidin-4-amine?
The canonical SMILES for 1-hydroxypiperidin-4-amine is NC1CCN(O)CC1.
What is the InChIKey of 1-hydroxypiperidin-4-amine?
The InChIKey is QTCJNHGVKMBNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c6-5-1-3-7(8)4-2-5/h5,8H,1-4,6H2.
What are the key properties of 1-hydroxypiperidin-4-amine?
1-hydroxypiperidin-4-amine has a molecular weight of 116.16 g/mol, XLogP of -0.20, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxypiperidin-4-amine is sourced from PubChem (CID 56972720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).