TL;DR: 3-(2-Methylpiperidin-1-yl)propyl phenoxyacetate (CAS 63906-45-6) is a chemical compound with molecular formula C17H25NO3 and molecular weight 291.18344 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-methylpiperidin-1-yl)propyl 2-phenoxyacetate
Also Known As: Phenoxyaceticacid3- propylester, 3-(2'-Methylpiperidino)propyl phenoxyacetate, 3-(2-Methylpiperidin-1-yl)propyl phenoxyacetate, 3-(2-methylpiperidin-1-yl)propyl 2-phenoxyacetate, Phenoxyacetic acid 3-(2-methylpiperidino)propyl ester
| Molecular Formula | C17H25NO3 |
| Molecular Weight | 291.18344 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 291.18344 Da |
| Heavy Atoms | 21 |
| Complexity | 302.0 |
| SMILES | CC1CCCCN1CCCOC(=O)COC2=CC=CC=C2 |
| InChIKey | DPFSZEXJIOUDSW-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that 3-(2-Methylpiperidin-1-yl)propyl phenoxyacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 3-(2-Methylpiperidin-1-yl)propyl phenoxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Methylpiperidin-1-yl)propyl phenoxyacetate has 0 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 3-(2-Methylpiperidin-1-yl)propyl phenoxyacetate is 63906-45-6.
The molecular formula of 3-(2-Methylpiperidin-1-yl)propyl phenoxyacetate is C17H25NO3.
The molecular weight of 3-(2-Methylpiperidin-1-yl)propyl phenoxyacetate is 291.18344 g/mol.
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