TL;DR: 2-[2-(3,5-Dimethyl-1-piperidinyl)ethoxy]benzaldehyde hydrochloride (CAS 1052515-59-9) is a chemical compound with molecular formula C16H24ClNO2 and molecular weight 297.14957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(3,5-dimethylpiperidin-1-yl)ethoxy]benzaldehyde;hydrochloride
Also Known As: 2-[2-(3,5-dimethyl-1-piperidinyl)ethoxy]benzaldehyde hydrochloride, 2-[2-(3,5-dimethylpiperidin-1-yl)ethoxy]benzaldehyde hydrochloride, 2-[2-(3,5-Dimethyl-1-piperidinyl)ethoxy]benzaldehyde HCl, 2-[2-(3,5-dimethylpiperidin-1-yl)ethoxy]benzaldehyde;hydrochloride, 2-(2-(3,5-Dimethylpiperidin-1-yl)ethoxy)benzaldehyde hydrochloride
| Molecular Formula | C16H24ClNO2 |
| Molecular Weight | 297.14957 g/mol |
| XLogP | 3.2776 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.14957 Da |
| Heavy Atoms | 20 |
| Complexity | 272.0 |
| SMILES | CC1CC(CN(C1)CCOC2=CC=CC=C2C=O)C.Cl |
| InChIKey | QFXKSZXSWRDCPL-UHFFFAOYSA-N |
The XLogP value of 3.2776 indicates that 2-[2-(3,5-Dimethyl-1-piperidinyl)ethoxy]benzaldehyde hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-[2-(3,5-Dimethyl-1-piperidinyl)ethoxy]benzaldehyde hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(3,5-Dimethyl-1-piperidinyl)ethoxy]benzaldehyde hydrochloride 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 2-[2-(3,5-Dimethyl-1-piperidinyl)ethoxy]benzaldehyde hydrochloride is 1052515-59-9.
The molecular formula of 2-[2-(3,5-Dimethyl-1-piperidinyl)ethoxy]benzaldehyde hydrochloride is C16H24ClNO2.
The molecular weight of 2-[2-(3,5-Dimethyl-1-piperidinyl)ethoxy]benzaldehyde hydrochloride is 297.14957 g/mol.
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