TL;DR: (4-Methyl-piperazin-1-yl)-(S)-pyrrolidin-2-yl-methanone (CAS 100158-68-7) is a chemical compound with molecular formula C10H19N3O and molecular weight 197.15282 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methylpiperazin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
Also Known As: (4-Methyl-piperazin-1-yl)-(S)-pyrrolidin-2-yl-methanone, (S)-1-methyl-4-prolylpiperazine, 1-methyl-4-(L-prolyl)piperazine, 2-<(diethylamino)methyl>piperidine, (S)-(4-Methylpiperazin-1-yl)(pyrrolidin-2-yl)methanone
| Molecular Formula | C10H19N3O |
| Molecular Weight | 197.15282 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.15282 Da |
| Heavy Atoms | 14 |
| Complexity | 211.0 |
| SMILES | CN1CCN(CC1)C(=O)[C@@H]2CCCN2 |
| InChIKey | FXYNRDLXGBFSTB-VIFPVBQESA-N |
The XLogP value of -0.3 indicates that (4-Methyl-piperazin-1-yl)-(S)-pyrrolidin-2-yl-methanone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 35.6 Ų, (4-Methyl-piperazin-1-yl)-(S)-pyrrolidin-2-yl-methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methyl-piperazin-1-yl)-(S)-pyrrolidin-2-yl-methanone 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 (4-Methyl-piperazin-1-yl)-(S)-pyrrolidin-2-yl-methanone is 100158-68-7.
The molecular formula of (4-Methyl-piperazin-1-yl)-(S)-pyrrolidin-2-yl-methanone is C10H19N3O.
The molecular weight of (4-Methyl-piperazin-1-yl)-(S)-pyrrolidin-2-yl-methanone is 197.15282 g/mol.
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