TL;DR: 1-(2-Hydroxyethyl)-2,3-dimethylpiperidin-4-one (CAS 1212309-83-5) is a chemical compound with molecular formula C9H17NO2 and molecular weight 171.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-hydroxyethyl)-2,3-dimethylpiperidin-4-one
Also Known As: 1-(2-hydroxyethyl)-2,3-dimethylpiperidin-4-one, ZERO/005047, AB01324982-02, 1-(2-hydroxyethyl)-2,3-dimethyl-piperidin-4-one, Piperidin-4-one, 1-(2-hydroxyethyl)-2,3-dimethyl-
| Molecular Formula | C9H17NO2 |
| Molecular Weight | 171.12593 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.12593 Da |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
| SMILES | CC1C(N(CCC1=O)CCO)C |
| InChIKey | QHAITLLROGOFFC-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Hydroxyethyl)-2,3-dimethylpiperidin-4-one. With a topological polar surface area (TPSA) of 40.5 Ų, 1-(2-Hydroxyethyl)-2,3-dimethylpiperidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Hydroxyethyl)-2,3-dimethylpiperidin-4-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2-Hydroxyethyl)-2,3-dimethylpiperidin-4-one is 1212309-83-5.
The molecular formula of 1-(2-Hydroxyethyl)-2,3-dimethylpiperidin-4-one is C9H17NO2.
The molecular weight of 1-(2-Hydroxyethyl)-2,3-dimethylpiperidin-4-one is 171.12593 g/mol.
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