TL;DR: 1-(2-Chloroethyl)-3-methylpiperidine (CAS 10298-11-0) is a chemical compound with molecular formula C8H16ClN and molecular weight 161.09712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-chloroethyl)-3-methylpiperidine
Also Known As: 1-(2-Chloroethyl)-3-methylpiperidine, starbld0024211, KST-1A9648, 1-(2-chloroethyl)-3-methyl-piperidine, Piperidine,1-(2-chloroethyl)-3-methyl-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H16ClN |
| Molecular Weight | 161.09712 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 161.09712 Da |
| Heavy Atoms | 10 |
| Complexity | 95.0 |
| SMILES | CC1CCCN(C1)CCCl |
| InChIKey | ZMTCYZCFHILUTI-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethyl)-3-methylpiperidine. With a topological polar surface area (TPSA) of 3.2 Ų, 1-(2-Chloroethyl)-3-methylpiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroethyl)-3-methylpiperidine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2-Chloroethyl)-3-methylpiperidine is 10298-11-0.
The molecular formula of 1-(2-Chloroethyl)-3-methylpiperidine is C8H16ClN.
The molecular weight of 1-(2-Chloroethyl)-3-methylpiperidine is 161.09712 g/mol.
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