TL;DR: 1-Naphthalenemethylamine, N-(2-chloroethyl)-N-methyl- (CAS 101931-25-3) is a chemical compound with molecular formula C14H16ClN and molecular weight 233.09712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-methyl-N-(naphthalen-1-ylmethyl)ethanamine
Also Known As: N-(2-Chloroethyl)-N-methylnaphthalene-1-methylamine, 1-NAPHTHALENEMETHYLAMINE, N-(2-CHLOROETHYL)-N-METHYL-, 2-chloro-N-methyl-N-(naphthalen-1-ylmethyl)ethanamine, N-(2-Chloroethyl)-N-methyl-1-naphthalenemethanamine, (2-chloroethyl)(methyl)[(naphthalen-1-yl)methyl]amine
| Molecular Formula | C14H16ClN |
| Molecular Weight | 233.09712 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.09712 Da |
| Heavy Atoms | 16 |
| Complexity | 207.0 |
| SMILES | CN(CCCl)CC1=CC=CC2=CC=CC=C21 |
| InChIKey | AKXXWMXQMAFEIQ-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 1-Naphthalenemethylamine, N-(2-chloroethyl)-N-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Naphthalenemethylamine, N-(2-chloroethyl)-N-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthalenemethylamine, N-(2-chloroethyl)-N-methyl- 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-Naphthalenemethylamine, N-(2-chloroethyl)-N-methyl- is 101931-25-3.
The molecular formula of 1-Naphthalenemethylamine, N-(2-chloroethyl)-N-methyl- is C14H16ClN.
The molecular weight of 1-Naphthalenemethylamine, N-(2-chloroethyl)-N-methyl- is 233.09712 g/mol.
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