About (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
(4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone (PubChem CID 66256555) has the molecular formula C17H32N2O2
and a molecular weight of 296.46 g/mol. Its IUPAC name is (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone.
Molecular Properties
| Compound Name | (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone |
| PubChem CID | 66256555 |
| Molecular Formula | C17H32N2O2 |
| Molecular Weight | 296.46 g/mol |
| Exact Mass | 296.25 |
| IUPAC Name | (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone |
| SMILES | CCCNC1COCC1C(=O)N1CCC(CC)(CC)CC1 |
| InChI | InChI=1S/C17H32N2O2/c1-4-9-18-15-13-21-12-14(15)16(20)19-10-7-17(5-2,6-3)8-11-19/h14-15,18H,4-13H2,1-3H3 |
| InChIKey | FHSYTBYUIAITPP-UHFFFAOYSA-N |
| XLogP | 2.43 |
| TPSA | 41.57 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 296.46 |
| LogP ≤ 5 | 2.43 |
| 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-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The IUPAC name of (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone (CID 66256555) is (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone.
What is the SMILES notation for (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The canonical SMILES for (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone is CCCNC1COCC1C(=O)N1CCC(CC)(CC)CC1.
What is the InChIKey of (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The InChIKey is FHSYTBYUIAITPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-4-9-18-15-13-21-12-14(15)16(20)19-10-7-17(5-2,6-3)8-11-19/h14-15,18H,4-13H2,1-3H3.
What are the key properties of (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
(4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone has a molecular weight of 296.46 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone is sourced from PubChem (CID 66256555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).