TL;DR: 1-(Piperidin-1-YL)propan-2-YL 2-iodobenzoate hydrochloride (CAS 1052518-81-6) is a chemical compound with molecular formula C15H21ClINO2 and molecular weight 409.03055 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-piperidin-1-ylpropan-2-yl 2-iodobenzoate;hydrochloride
Also Known As: 1-(1-piperidyl)propan-2-yl 2-iodobenzoate Hydrochloride, 1-piperidin-1-ylpropan-2-yl 2-iodobenzoate hydrochloride, 1-(PIPERIDIN-1-YL)PROPAN-2-YL 2-IODOBENZOATE HYDROCHLORIDE
| Molecular Formula | C15H21ClINO2 |
| Molecular Weight | 409.03055 g/mol |
| XLogP | 3.7442 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.03055 Da |
| Heavy Atoms | 20 |
| Complexity | 292.0 |
| SMILES | CC(CN1CCCCC1)OC(=O)C2=CC=CC=C2I.Cl |
| InChIKey | LFTMTVISNAPALW-UHFFFAOYSA-N |
The XLogP value of 3.7442 indicates that 1-(Piperidin-1-YL)propan-2-YL 2-iodobenzoate 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, 1-(Piperidin-1-YL)propan-2-YL 2-iodobenzoate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Piperidin-1-YL)propan-2-YL 2-iodobenzoate 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 1-(Piperidin-1-YL)propan-2-YL 2-iodobenzoate hydrochloride is 1052518-81-6.
The molecular formula of 1-(Piperidin-1-YL)propan-2-YL 2-iodobenzoate hydrochloride is C15H21ClINO2.
The molecular weight of 1-(Piperidin-1-YL)propan-2-YL 2-iodobenzoate hydrochloride is 409.03055 g/mol.
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