TL;DR: 3-(2-Methylpiperidin-1-yl)propyl 2-hydroxybenzoate (CAS 63916-86-9) is a chemical compound with molecular formula C16H23NO3 and molecular weight 277.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-methylpiperidin-1-yl)propyl 2-hydroxybenzoate
Also Known As: 3-(2-methylpiperidin-1-yl)propyl 2-hydroxybenzoate, 3-(2'-Methylpiperidino)propyl o-hydroxybenzoate, 1-Piperidinepropanol,2-hexyl-,1-benzoate, 3-(2-Methylpiperidino)propyl=o-hydroxybenzoate, BENZOIC ACID, o-HYDROXY-, 3-(2'-METHYLPIPERIDINO)PROPYL ESTER
| Molecular Formula | C16H23NO3 |
| Molecular Weight | 277.1678 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.1678 Da |
| Heavy Atoms | 20 |
| Complexity | 308.0 |
| SMILES | CC1CCCCN1CCCOC(=O)C2=CC=CC=C2O |
| InChIKey | PISUWIAFYNMOIB-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 3-(2-Methylpiperidin-1-yl)propyl 2-hydroxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 3-(2-Methylpiperidin-1-yl)propyl 2-hydroxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Methylpiperidin-1-yl)propyl 2-hydroxybenzoate 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 3-(2-Methylpiperidin-1-yl)propyl 2-hydroxybenzoate is 63916-86-9.
The molecular formula of 3-(2-Methylpiperidin-1-yl)propyl 2-hydroxybenzoate is C16H23NO3.
The molecular weight of 3-(2-Methylpiperidin-1-yl)propyl 2-hydroxybenzoate is 277.1678 g/mol.
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