TL;DR: 4-(3,5-Dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one (CAS 1005288-48-1) is a chemical compound with molecular formula C19H26N2O2 and molecular weight 314.19943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(3,5-dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one
Also Known As: ASN 13778864, 4-(3,5-dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one, 4-(3,5-Dimethyl-piperidine-1-carbonyl)-1-o-tolyl-pyrrolidin-2-one, 4-[(3,5-dimethylpiperidin-1-yl)carbonyl]-1-(2-methylphenyl)pyrrolidin-2-one, 4-[(3,5-dimethylpiperidyl)carbonyl]-1-(2-methylphenyl)pyrrolidin-2-one
| Molecular Formula | C19H26N2O2 |
| Molecular Weight | 314.19943 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.19943 Da |
| Heavy Atoms | 23 |
| Complexity | 454.0 |
| SMILES | CC1CC(CN(C1)C(=O)C2CC(=O)N(C2)C3=CC=CC=C3C)C |
| InChIKey | KWNZVABICVIOKB-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3,5-Dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one. With a topological polar surface area (TPSA) of 40.6 Ų, 4-(3,5-Dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,5-Dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one 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 4-(3,5-Dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one is 1005288-48-1.
The molecular formula of 4-(3,5-Dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one is C19H26N2O2.
The molecular weight of 4-(3,5-Dimethylpiperidine-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one is 314.19943 g/mol.
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