TL;DR: Phenethylamine, N-butyl-o-methoxy-alpha-methyl-, hydrochloride (CAS 100966-44-7) is a chemical compound with molecular formula C14H24ClNO and molecular weight 257.15463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-(2-methoxyphenyl)propan-2-yl]butan-1-amine;hydrochloride
Also Known As: N-Butyl-o-methoxy-alpha-methyl-phenethylamine hydrochloride, Phenethylamine, N-butyl-o-methoxy-alpha-methyl-, hydrochloride, N-[1-(2-methoxyphenyl)propan-2-yl]butan-1-amine hydrochloride, N-[1-(2-Methoxyphenyl)propan-2-yl]butan-1-amine--hydrogen chloride (1/1)
| Molecular Formula | C14H24ClNO |
| Molecular Weight | 257.15463 g/mol |
| XLogP | 3.4377 |
| Topological Polar Surface Area (TPSA) | 21.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 257.15463 Da |
| Heavy Atoms | 17 |
| Complexity | 172.0 |
| SMILES | CCCCNC(C)CC1=CC=CC=C1OC.Cl |
| InChIKey | YJKAEAABQZOAPK-UHFFFAOYSA-N |
The XLogP value of 3.4377 indicates that Phenethylamine, N-butyl-o-methoxy-alpha-methyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, Phenethylamine, N-butyl-o-methoxy-alpha-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenethylamine, N-butyl-o-methoxy-alpha-methyl-, hydrochloride has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Phenethylamine, N-butyl-o-methoxy-alpha-methyl-, hydrochloride is 100966-44-7.
The molecular formula of Phenethylamine, N-butyl-o-methoxy-alpha-methyl-, hydrochloride is C14H24ClNO.
The molecular weight of Phenethylamine, N-butyl-o-methoxy-alpha-methyl-, hydrochloride is 257.15463 g/mol.
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