rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate
TL;DR: rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate (CAS 109887-60-7) is a chemical compound with molecular formula C14H18FNO2 and molecular weight 251.13216 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (3S,4S)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate
Also Known As: rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate, rac-methyl(3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate,cis, Methyl 4-(4-fluorophenyl)-1-methyl-piperidine-3-carboxylate, (+/-)-cis-4-(4'-Fluorophenyl)-3-methoxycarbonyl-1-methyl-piperidine, (+/-)-cis-4-(4'-Fluorophenyl)-3-methoxycarbonyl-1-methylpiperidine
Technical Specifications
| Molecular Formula | C14H18FNO2 |
| Molecular Weight | 251.13216 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.13216 Da |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
| SMILES | CN1CC[C@@H]([C@@H](C1)C(=O)OC)C2=CC=C(C=C2)F |
| InChIKey | NTYATEQGMUSJQM-CHWSQXEVSA-N |
Chemical Property Profile of rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate
Property Insights of rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate. With a topological polar surface area (TPSA) of 29.5 Ų, rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate?
The CAS number of rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate is 109887-60-7.
What is the molecular formula of rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate?
The molecular formula of rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate is C14H18FNO2.
What is the molecular weight of rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate?
The molecular weight of rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate is 251.13216 g/mol.
Where can I buy rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate?
You can request a quote for rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for rac-methyl (3R,4R)-4-(4-fluorophenyl)-1-methylpiperidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.