TL;DR: 1-[(4-Ethoxyphenyl)methyl]piperidine-2-carboxylic acid (CAS 1037494-76-0) is a chemical compound with molecular formula C15H21NO3 and molecular weight 263.15213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(4-ethoxyphenyl)methyl]piperidine-2-carboxylic acid
Also Known As: 1-[(4-ethoxyphenyl)methyl]piperidine-2-carboxylic Acid, 1-[(4-ethoxyphenyl)methyl]-2-piperidinecarboxylic acid
| Molecular Formula | C15H21NO3 |
| Molecular Weight | 263.15213 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.15213 Da |
| Heavy Atoms | 19 |
| Complexity | 287.0 |
| SMILES | CCOC1=CC=C(C=C1)CN2CCCCC2C(=O)O |
| InChIKey | WTHNFSDTVDHLCH-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Ethoxyphenyl)methyl]piperidine-2-carboxylic acid. With a topological polar surface area (TPSA) of 49.8 Ų, 1-[(4-Ethoxyphenyl)methyl]piperidine-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Ethoxyphenyl)methyl]piperidine-2-carboxylic acid 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 1-[(4-Ethoxyphenyl)methyl]piperidine-2-carboxylic acid is 1037494-76-0.
The molecular formula of 1-[(4-Ethoxyphenyl)methyl]piperidine-2-carboxylic acid is C15H21NO3.
The molecular weight of 1-[(4-Ethoxyphenyl)methyl]piperidine-2-carboxylic acid is 263.15213 g/mol.
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