TL;DR: 3-Phenoxypiperidine (CAS 1171992-10-1) is a chemical compound with molecular formula C11H15NO and molecular weight 177.11537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenoxypiperidine
Also Known As: 3-phenoxypiperidine, 3-Phenoxy-piperidine, Heptanimidamide, Piperidine, 3-phenoxy-, Piperidine,3-phenoxy-
| Molecular Formula | C11H15NO |
| Molecular Weight | 177.11537 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.11537 Da |
| Heavy Atoms | 13 |
| Complexity | 143.0 |
| SMILES | C1CC(CNC1)OC2=CC=CC=C2 |
| InChIKey | QDPNIJKUTWDGMV-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenoxypiperidine. With a topological polar surface area (TPSA) of 21.3 Ų, 3-Phenoxypiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenoxypiperidine has 1 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-Phenoxypiperidine is 1171992-10-1.
The molecular formula of 3-Phenoxypiperidine is C11H15NO.
The molecular weight of 3-Phenoxypiperidine is 177.11537 g/mol.
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