TL;DR: 3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde (CAS 164920-88-1) is a chemical compound with molecular formula C15H21NO and molecular weight 231.16231 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(3S)-1-propylpiperidin-3-yl]benzaldehyde
Also Known As: 3-(1-propylpiperidin-3-yl)benzaldehyde, 3-[(3R)-1-propyl-3-piperidyl]benzaldehyde, 3-[(3S)-1-propylpiperidin-3-yl]benzaldehyde, 3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde, 3-[(3S)-1-Propylpiperidin-3alpha-yl]benzaldehyde
| Molecular Formula | C15H21NO |
| Molecular Weight | 231.16231 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.16231 Da |
| Heavy Atoms | 17 |
| Complexity | 241.0 |
| SMILES | CCCN1CCC[C@H](C1)C2=CC=CC(=C2)C=O |
| InChIKey | UQOWIEJFNPPPBP-OAHLLOKOSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde. With a topological polar surface area (TPSA) of 20.3 Ų, 3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde is 164920-88-1.
The molecular formula of 3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde is C15H21NO.
The molecular weight of 3-((S)-1-Propyl-piperidin-3-yl)-benzaldehyde is 231.16231 g/mol.
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