(2S)-1-benzoyl-2-methylpiperidin-4-one
TL;DR: (2S)-1-benzoyl-2-methylpiperidin-4-one (CAS 1346773-40-7) is a chemical compound with molecular formula C13H15NO2 and molecular weight 217.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-benzoyl-2-methylpiperidin-4-one
Also Known As: ZERO/005785, 1-benzoyl-2(s)-methyl-4-piperidone, (2S)-1-benzoyl-2-methylpiperidin-4-one
Technical Specifications
| Molecular Formula | C13H15NO2 |
| Molecular Weight | 217.11028 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.11028 Da |
| Heavy Atoms | 16 |
| Complexity | 282.0 |
| SMILES | C[C@H]1CC(=O)CCN1C(=O)C2=CC=CC=C2 |
| InChIKey | QAHSDYAKLVNWDV-JTQLQIEISA-N |
Chemical Property Profile of (2S)-1-benzoyl-2-methylpiperidin-4-one
Property Insights of (2S)-1-benzoyl-2-methylpiperidin-4-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-1-benzoyl-2-methylpiperidin-4-one. With a topological polar surface area (TPSA) of 37.4 Ų, (2S)-1-benzoyl-2-methylpiperidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-1-benzoyl-2-methylpiperidin-4-one has 0 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 (2S)-1-benzoyl-2-methylpiperidin-4-one?
The CAS number of (2S)-1-benzoyl-2-methylpiperidin-4-one is 1346773-40-7.
What is the molecular formula of (2S)-1-benzoyl-2-methylpiperidin-4-one?
The molecular formula of (2S)-1-benzoyl-2-methylpiperidin-4-one is C13H15NO2.
What is the molecular weight of (2S)-1-benzoyl-2-methylpiperidin-4-one?
The molecular weight of (2S)-1-benzoyl-2-methylpiperidin-4-one is 217.11028 g/mol.
Where can I buy (2S)-1-benzoyl-2-methylpiperidin-4-one?
You can request a quote for (2S)-1-benzoyl-2-methylpiperidin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2S)-1-benzoyl-2-methylpiperidin-4-one?
Yes, CoreyChem provides custom synthesis services for (2S)-1-benzoyl-2-methylpiperidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.