TL;DR: Piperidine, 1-(2-(benzyl(p-methoxybenzyl)amino)ethyl)-, dihydrochloride (CAS 101997-55-1) is a chemical compound with molecular formula C22H32Cl2N2O and molecular weight 410.18918 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylethanamine;dihydrochloride
Also Known As: Piperidine, 1-(2-(benzyl(p-methoxybenzyl)amino)ethyl)-, dihydrochloride, 1-(2-(Benzyl(p-methoxybenzyl)amino)ethyl)piperidine dihydrochloride, N-benzyl-N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylethanamine dihydrochloride, N-Benzyl-N-[(4-methoxyphenyl)methyl]-2-(piperidin-1-yl)ethan-1-amine--hydrogen chloride (1/2)
| Molecular Formula | C22H32Cl2N2O |
| Molecular Weight | 410.18918 g/mol |
| XLogP | 5.0269 |
| Topological Polar Surface Area (TPSA) | 15.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 410.18918 Da |
| Heavy Atoms | 27 |
| Complexity | 342.0 |
| SMILES | COC1=CC=C(C=C1)CN(CCN2CCCCC2)CC3=CC=CC=C3.Cl.Cl |
| InChIKey | ZBWRSPGXXBQCFA-UHFFFAOYSA-N |
The XLogP value of 5.0269 indicates that Piperidine, 1-(2-(benzyl(p-methoxybenzyl)amino)ethyl)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.7 Ų, Piperidine, 1-(2-(benzyl(p-methoxybenzyl)amino)ethyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidine, 1-(2-(benzyl(p-methoxybenzyl)amino)ethyl)-, dihydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Piperidine, 1-(2-(benzyl(p-methoxybenzyl)amino)ethyl)-, dihydrochloride is 101997-55-1.
The molecular formula of Piperidine, 1-(2-(benzyl(p-methoxybenzyl)amino)ethyl)-, dihydrochloride is C22H32Cl2N2O.
The molecular weight of Piperidine, 1-(2-(benzyl(p-methoxybenzyl)amino)ethyl)-, dihydrochloride is 410.18918 g/mol.
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