TL;DR: Benzylamine, 3-allyl-6-(2-(dimethylamino)ethoxy)-5-methoxy- (CAS 100427-79-0) is a chemical compound with molecular formula C15H24N2O2 and molecular weight 264.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(aminomethyl)-6-methoxy-4-prop-2-enylphenoxy]-N,N-dimethylethanamine
Also Known As: 3-Allyl-6-(2-(dimethylamino)ethoxy)-5-methoxybenzylamine, BENZYLAMINE, 3-ALLYL-6-(2-(DIMETHYLAMINO)ETHOXY)-5-METHOXY-, 2-[2-(aminomethyl)-6-methoxy-4-prop-2-enylphenoxy]-N,N-dimethylethanamine, 3-Allyl-6-[2-(dimethylamino)ethoxy]-5-methoxybenzylamine, 1-{2-[2-(dimethylamino)ethoxy]-3-methoxy-5-(prop-2-en-1-yl)phenyl}methanamine
| Molecular Formula | C15H24N2O2 |
| Molecular Weight | 264.18378 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 47.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 264.18378 Da |
| Heavy Atoms | 19 |
| Complexity | 259.0 |
| SMILES | CN(C)CCOC1=C(C=C(C=C1OC)CC=C)CN |
| InChIKey | FHKTWPDDTIABFM-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzylamine, 3-allyl-6-(2-(dimethylamino)ethoxy)-5-methoxy-. With a topological polar surface area (TPSA) of 47.7 Ų, Benzylamine, 3-allyl-6-(2-(dimethylamino)ethoxy)-5-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylamine, 3-allyl-6-(2-(dimethylamino)ethoxy)-5-methoxy- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzylamine, 3-allyl-6-(2-(dimethylamino)ethoxy)-5-methoxy- is 100427-79-0.
The molecular formula of Benzylamine, 3-allyl-6-(2-(dimethylamino)ethoxy)-5-methoxy- is C15H24N2O2.
The molecular weight of Benzylamine, 3-allyl-6-(2-(dimethylamino)ethoxy)-5-methoxy- is 264.18378 g/mol.
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