TL;DR: 1-(3-Phenylpropanoyl)piperidine-4-carboxylic acid (CAS 147636-42-8) is a chemical compound with molecular formula C15H19NO3 and molecular weight 261.1365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-phenylpropanoyl)piperidine-4-carboxylic acid
Also Known As: 1-(3-phenylpropanoyl)piperidine-4-carboxylic acid, Maybridge3_002462, 4-Piperidinecarboxylic acid, 1-(1-oxo-3-phenylpropyl)-, IDI1_013849, 1-(3-phenylpropanoyl)-4-piperidinecarboxylic acid
| Molecular Formula | C15H19NO3 |
| Molecular Weight | 261.1365 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.1365 Da |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
| SMILES | C1CN(CCC1C(=O)O)C(=O)CCC2=CC=CC=C2 |
| InChIKey | WQOSVYASWDJHLK-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Phenylpropanoyl)piperidine-4-carboxylic acid. With a topological polar surface area (TPSA) of 57.6 Ų, 1-(3-Phenylpropanoyl)piperidine-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Phenylpropanoyl)piperidine-4-carboxylic acid 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 1-(3-Phenylpropanoyl)piperidine-4-carboxylic acid is 147636-42-8.
The molecular formula of 1-(3-Phenylpropanoyl)piperidine-4-carboxylic acid is C15H19NO3.
The molecular weight of 1-(3-Phenylpropanoyl)piperidine-4-carboxylic acid is 261.1365 g/mol.
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