TL;DR: 3,4-Methylenedioxyethylamphetamine (CAS 101314-46-9) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1,3-benzodioxol-5-yl)-N-ethylethanamine
Also Known As: 3,4-Methylenedioxyethylamphetamine, 1-(3,4-Methylenedioxyphenyl)-N-ethylethylamine, 1-(1,3-benzodioxol-5-yl)-N-ethylethanamine, 1,3-Benzodioxole-5-methanamine, N-ethyl-alpha-methyl-, 1,3-BENZODIOXOLE-5-METHANAMINE, N-ETHYL-.ALPHA.-METHYL-
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.11028 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.11028 Da |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
| SMILES | CCNC(C)C1=CC2=C(C=C1)OCO2 |
| InChIKey | UOKBMEQKXXANRQ-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Methylenedioxyethylamphetamine. With a topological polar surface area (TPSA) of 30.5 Ų, 3,4-Methylenedioxyethylamphetamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Methylenedioxyethylamphetamine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,4-Methylenedioxyethylamphetamine is 101314-46-9.
The molecular formula of 3,4-Methylenedioxyethylamphetamine is C11H15NO2.
The molecular weight of 3,4-Methylenedioxyethylamphetamine is 193.11028 g/mol.
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