TL;DR: 1-(1-ethylpyrrolidin-2-yl)-N-(3,4,5-trimethoxybenzyl)methanamine dihydrochloride (CAS 1185470-42-1) is a chemical compound with molecular formula C17H30Cl2N2O3 and molecular weight 380.16336 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1-ethylpyrrolidin-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine;dihydrochloride
Also Known As: 1-(1-ethylpyrrolidin-2-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine Dihydrochloride, 1-(1-ethylpyrrolidin-2-yl)-N-(3,4,5-trimethoxybenzyl)methanamine dihydrochloride
| Molecular Formula | C17H30Cl2N2O3 |
| Molecular Weight | 380.16336 g/mol |
| XLogP | 3.1299 |
| Topological Polar Surface Area (TPSA) | 43.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 380.16336 Da |
| Heavy Atoms | 24 |
| Complexity | 302.0 |
| SMILES | CCN1CCCC1CNCC2=CC(=C(C(=C2)OC)OC)OC.Cl.Cl |
| InChIKey | PKHCZPZAZQPOMW-UHFFFAOYSA-N |
The XLogP value of 3.1299 indicates that 1-(1-ethylpyrrolidin-2-yl)-N-(3,4,5-trimethoxybenzyl)methanamine dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.0 Ų, 1-(1-ethylpyrrolidin-2-yl)-N-(3,4,5-trimethoxybenzyl)methanamine dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-ethylpyrrolidin-2-yl)-N-(3,4,5-trimethoxybenzyl)methanamine dihydrochloride has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(1-ethylpyrrolidin-2-yl)-N-(3,4,5-trimethoxybenzyl)methanamine dihydrochloride is 1185470-42-1.
The molecular formula of 1-(1-ethylpyrrolidin-2-yl)-N-(3,4,5-trimethoxybenzyl)methanamine dihydrochloride is C17H30Cl2N2O3.
The molecular weight of 1-(1-ethylpyrrolidin-2-yl)-N-(3,4,5-trimethoxybenzyl)methanamine dihydrochloride is 380.16336 g/mol.
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