TL;DR: 3-Phenylpropenoic acid 3-(2-methylpiperidino)propyl ester (CAS 63938-15-8) is a chemical compound with molecular formula C18H25NO2 and molecular weight 287.18854 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-methylpiperidin-1-yl)propyl 3-phenylprop-2-enoate
Also Known As: 3-Phenylpropenoic acid 3-(2-methylpiperidino)propyl ester
| Molecular Formula | C18H25NO2 |
| Molecular Weight | 287.18854 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 287.18854 Da |
| Heavy Atoms | 21 |
| Complexity | 334.0 |
| SMILES | CC1CCCCN1CCCOC(=O)C=CC2=CC=CC=C2 |
| InChIKey | SEBFSSWJENDFFN-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 3-Phenylpropenoic acid 3-(2-methylpiperidino)propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Phenylpropenoic acid 3-(2-methylpiperidino)propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenylpropenoic acid 3-(2-methylpiperidino)propyl ester has 0 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 3-Phenylpropenoic acid 3-(2-methylpiperidino)propyl ester is 63938-15-8.
The molecular formula of 3-Phenylpropenoic acid 3-(2-methylpiperidino)propyl ester is C18H25NO2.
The molecular weight of 3-Phenylpropenoic acid 3-(2-methylpiperidino)propyl ester is 287.18854 g/mol.
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