TL;DR: 5-Methyl-3-(methylamino)-1-phenylpyrrolidin-2-one (CAS 91557-14-1) is a chemical compound with molecular formula C12H16N2O and molecular weight 204.12627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-3-(methylamino)-1-phenylpyrrolidin-2-one
Also Known As: 5-methyl-3-methylamino-1-phenyl-pyrrolidin-2-one, 5-methyl-3-(methylamino)-1-phenylpyrrolidin-2-one
| Molecular Formula | C12H16N2O |
| Molecular Weight | 204.12627 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.12627 Da |
| Heavy Atoms | 15 |
| Complexity | 236.0 |
| SMILES | CC1CC(C(=O)N1C2=CC=CC=C2)NC |
| InChIKey | FSENUEGUYFSISL-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-3-(methylamino)-1-phenylpyrrolidin-2-one. With a topological polar surface area (TPSA) of 32.3 Ų, 5-Methyl-3-(methylamino)-1-phenylpyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-3-(methylamino)-1-phenylpyrrolidin-2-one has 1 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 5-Methyl-3-(methylamino)-1-phenylpyrrolidin-2-one is 91557-14-1.
The molecular formula of 5-Methyl-3-(methylamino)-1-phenylpyrrolidin-2-one is C12H16N2O.
The molecular weight of 5-Methyl-3-(methylamino)-1-phenylpyrrolidin-2-one is 204.12627 g/mol.
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