TL;DR: 2-(2-Methylphenoxy)-1-(piperazin-1-yl)ethan-1-one (CAS 143999-85-3) is a chemical compound with molecular formula C13H18N2O2 and molecular weight 234.13683 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-methylphenoxy)-1-piperazin-1-ylethanone
Also Known As: 2-(2-methylphenoxy)-1-(piperazin-1-yl)ethan-1-one, 2-(2-methylphenoxy)-1-piperazin-1-ylethanone, 2-(2-methylphenoxy)-1-piperazin-1-yl-ethanone, G25352
| Molecular Formula | C13H18N2O2 |
| Molecular Weight | 234.13683 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.13683 Da |
| Heavy Atoms | 17 |
| Complexity | 252.0 |
| SMILES | CC1=CC=CC=C1OCC(=O)N2CCNCC2 |
| InChIKey | WMWXCDQYAOXPGE-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methylphenoxy)-1-(piperazin-1-yl)ethan-1-one. With a topological polar surface area (TPSA) of 41.6 Ų, 2-(2-Methylphenoxy)-1-(piperazin-1-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Methylphenoxy)-1-(piperazin-1-yl)ethan-1-one 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 2-(2-Methylphenoxy)-1-(piperazin-1-yl)ethan-1-one is 143999-85-3.
The molecular formula of 2-(2-Methylphenoxy)-1-(piperazin-1-yl)ethan-1-one is C13H18N2O2.
The molecular weight of 2-(2-Methylphenoxy)-1-(piperazin-1-yl)ethan-1-one is 234.13683 g/mol.
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