TL;DR: N-(2-morpholinoethyl)-3-phenylprop-2-yn-1-amine dihydrochloride (CAS 1052527-95-3) is a chemical compound with molecular formula C15H22Cl2N2O and molecular weight 316.11093 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-morpholin-4-ylethyl)-3-phenylprop-2-yn-1-amine;dihydrochloride
Also Known As: N-(2-morpholinoethyl)-3-phenylprop-2-yn-1-amine dihydrochloride, N-(2-morpholin-4-ylethyl)-3-phenyl-prop-2-yn-1-amine Dihydrochloride, N-(2-morpholin-4-ylethyl)-3-phenylprop-2-yn-1-amine dihydrochloride
| Molecular Formula | C15H22Cl2N2O |
| Molecular Weight | 316.11093 g/mol |
| XLogP | 1.8035 |
| Topological Polar Surface Area (TPSA) | 24.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.11093 Da |
| Heavy Atoms | 20 |
| Complexity | 279.0 |
| SMILES | C1COCCN1CCNCC#CC2=CC=CC=C2.Cl.Cl |
| InChIKey | CYOMNUDDDACDJS-UHFFFAOYSA-N |
The XLogP value of 1.8035 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-morpholinoethyl)-3-phenylprop-2-yn-1-amine dihydrochloride. With a topological polar surface area (TPSA) of 24.5 Ų, N-(2-morpholinoethyl)-3-phenylprop-2-yn-1-amine dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-morpholinoethyl)-3-phenylprop-2-yn-1-amine dihydrochloride has 3 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 N-(2-morpholinoethyl)-3-phenylprop-2-yn-1-amine dihydrochloride is 1052527-95-3.
The molecular formula of N-(2-morpholinoethyl)-3-phenylprop-2-yn-1-amine dihydrochloride is C15H22Cl2N2O.
The molecular weight of N-(2-morpholinoethyl)-3-phenylprop-2-yn-1-amine dihydrochloride is 316.11093 g/mol.
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