TL;DR: (+-)-Anabasine (CAS 13078-04-1) is a chemical compound with molecular formula C10H14N2 and molecular weight 162.11569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-piperidin-2-ylpyridine
Also Known As: Anabasine, 3-(piperidin-2-yl)pyridine, (+/-)-Anabasine, Neonicotine, DL-Anabasine
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H14N2 |
| Molecular Weight | 162.11569 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 24.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 162.11569 Da |
| Heavy Atoms | 12 |
| Complexity | 136.0 |
| Melting Point | 9 °C |
| Solubility | 1000 mg/mL at 25 °C |
| SMILES | C1CCNC(C1)C2=CN=CC=C2 |
| InChIKey | MTXSIJUGVMTTMU-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+-)-Anabasine. With a topological polar surface area (TPSA) of 24.9 Ų, (+-)-Anabasine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+-)-Anabasine 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 (+-)-Anabasine is 13078-04-1.
The molecular formula of (+-)-Anabasine is C10H14N2.
The molecular weight of (+-)-Anabasine is 162.11569 g/mol.
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