TL;DR: 4-(2-Methylpiperidin-1-yl)pentanoic acid--hydrogen chloride (1/1) (CAS 63690-20-0) is a chemical compound with molecular formula C11H22ClNO2 and molecular weight 235.13391 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-methylpiperidin-1-yl)pentanoic acid;hydrochloride
Also Known As: DF 572, 5-(2-Methylpiperidino)valeric acid hydrochloride, 4-(2-methylpiperidin-1-yl)pentanoic acid hydrochloride(1:1), Valeric acid, 5-(2-methylpiperidino)-, hydrochloride, Pentanoic acid, 5-(2-methylpiperidino)-, hydrochloride
| Molecular Formula | C11H22ClNO2 |
| Molecular Weight | 235.13391 g/mol |
| XLogP | 2.54 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.13391 Da |
| Heavy Atoms | 15 |
| Complexity | 194.0 |
| SMILES | CC1CCCCN1C(C)CCC(=O)O.Cl |
| InChIKey | KATSCRAXYYEIOB-UHFFFAOYSA-N |
The XLogP value of 2.54 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Methylpiperidin-1-yl)pentanoic acid--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 40.5 Ų, 4-(2-Methylpiperidin-1-yl)pentanoic acid--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Methylpiperidin-1-yl)pentanoic acid--hydrogen chloride (1/1) has 2 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 4-(2-Methylpiperidin-1-yl)pentanoic acid--hydrogen chloride (1/1) is 63690-20-0.
The molecular formula of 4-(2-Methylpiperidin-1-yl)pentanoic acid--hydrogen chloride (1/1) is C11H22ClNO2.
The molecular weight of 4-(2-Methylpiperidin-1-yl)pentanoic acid--hydrogen chloride (1/1) is 235.13391 g/mol.
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