About 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide
4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide (PubChem CID 153405690) has the molecular formula C9H16N2O3
and a molecular weight of 200.24 g/mol. Its IUPAC name is 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide.
Molecular Properties
| Compound Name | 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide |
| PubChem CID | 153405690 |
| Molecular Formula | C9H16N2O3 |
| Molecular Weight | 200.24 g/mol |
| Exact Mass | 200.12 |
| IUPAC Name | 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide |
| SMILES | NC(=O)C1(O)CCN(C2COC2)CC1 |
| InChI | InChI=1S/C9H16N2O3/c10-8(12)9(13)1-3-11(4-2-9)7-5-14-6-7/h7,13H,1-6H2,(H2,10,12) |
| InChIKey | HUWJIHHJXLGAFW-UHFFFAOYSA-N |
| XLogP | -1.30 |
| TPSA | 75.79 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 200.24 |
| LogP ≤ 5 | -1.30 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide?
The IUPAC name of 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide (CID 153405690) is 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide.
What is the SMILES notation for 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide?
The canonical SMILES for 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide is NC(=O)C1(O)CCN(C2COC2)CC1.
What is the InChIKey of 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide?
The InChIKey is HUWJIHHJXLGAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c10-8(12)9(13)1-3-11(4-2-9)7-5-14-6-7/h7,13H,1-6H2,(H2,10,12).
What are the key properties of 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide?
4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide has a molecular weight of 200.24 g/mol, XLogP of -1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-(oxetan-3-yl)piperidine-4-carboxamide is sourced from PubChem (CID 153405690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).