TL;DR: 3-[(2S)-1-(oct-2-yn-1-yl)piperidin-2-yl]pyridine (CAS 1072878-17-1) is a chemical compound with molecular formula C18H26N2 and molecular weight 270.2096 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2S)-1-oct-2-ynylpiperidin-2-yl]pyridine
Also Known As: 3-((2S)-1-oct-2-ynyl-2-piperidyl)pyridine, 3-[(2S)-1-oct-2-ynylpiperidin-2-yl]pyridine, (S)-3-(1-(oct-2-yn-1-yl)piperidin-2-yl)pyridine, 3-[(2S)-1-(oct-2-yn-1-yl)piperidin-2-yl]pyridine, 3-[(2S)-1-(2-OCTYN-1-YL)-2-PIPERIDINYL]PYRIDINE
| Molecular Formula | C18H26N2 |
| Molecular Weight | 270.2096 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 16.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.2096 Da |
| Heavy Atoms | 20 |
| Complexity | 325.0 |
| SMILES | CCCCCC#CCN1CCCC[C@H]1C2=CN=CC=C2 |
| InChIKey | LFGKVBBGXRWEQI-SFHVURJKSA-N |
The XLogP value of 3.6 indicates that 3-[(2S)-1-(oct-2-yn-1-yl)piperidin-2-yl]pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.1 Ų, 3-[(2S)-1-(oct-2-yn-1-yl)piperidin-2-yl]pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(2S)-1-(oct-2-yn-1-yl)piperidin-2-yl]pyridine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-[(2S)-1-(oct-2-yn-1-yl)piperidin-2-yl]pyridine is 1072878-17-1.
The molecular formula of 3-[(2S)-1-(oct-2-yn-1-yl)piperidin-2-yl]pyridine is C18H26N2.
The molecular weight of 3-[(2S)-1-(oct-2-yn-1-yl)piperidin-2-yl]pyridine is 270.2096 g/mol.
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