(3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone
TL;DR: (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone (CAS 1026544-14-8) is a chemical compound with molecular formula C9H18N2O and molecular weight 170.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,6S)-3-methyl-6-(2-methylpropyl)piperazin-2-one
Also Known As: (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone, (3S,6S)-3-methyl-6-(2-methylpropyl)piperazin-2-one
Technical Specifications
| Molecular Formula | C9H18N2O |
| Molecular Weight | 170.1419 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.1419 Da |
| Heavy Atoms | 12 |
| Complexity | 168.0 |
| SMILES | C[C@H]1C(=O)N[C@H](CN1)CC(C)C |
| InChIKey | GIUCPRIRMWOGPM-YUMQZZPRSA-N |
Chemical Property Profile of (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone
Property Insights of (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone. With a topological polar surface area (TPSA) of 41.1 Ų, (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone?
The CAS number of (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone is 1026544-14-8.
What is the molecular formula of (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone?
The molecular formula of (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone is C9H18N2O.
What is the molecular weight of (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone?
The molecular weight of (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone is 170.1419 g/mol.
Where can I buy (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone?
You can request a quote for (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone?
Yes, CoreyChem provides custom synthesis services for (3S,6S)-3-Methyl-6-(2-methylpropyl)-2-piperazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.