TL;DR: Ethyl 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate (CAS 152754-33-1) is a chemical compound with molecular formula C15H25NO4 and molecular weight 283.17834 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 1-(3,3-dimethyl-2-oxopentanoyl)piperidine-2-carboxylate
Also Known As: (S)-Ethyl 1-(3,3-dimethyl-2-oxopentanoyl)piperidine-2-carboxylate, Ethyl 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate, ethyl (S)-1-(3,3-dimethyl-2-oxopentanoyl)piperidine-2-carboxylate, ethyl 1-(1,2-dioxo-3,3-dimethylpentyl)-2-piperidinecarboxylate, 1-(3,3-Dimethyl-2-oxo-pentanoyl)-piperidine-2-carboxylic acid ethyl ester
| Molecular Formula | C15H25NO4 |
| Molecular Weight | 283.17834 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 283.17834 Da |
| Heavy Atoms | 20 |
| Complexity | 389.0 |
| SMILES | CCC(C)(C)C(=O)C(=O)N1CCCCC1C(=O)OCC |
| InChIKey | CAXFSIWSCHLEMR-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethyl 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate is 152754-33-1.
The molecular formula of Ethyl 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate is C15H25NO4.
The molecular weight of Ethyl 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate is 283.17834 g/mol.
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