Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate
TL;DR: Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate (CAS 1015070-53-7) is a chemical compound with molecular formula C15H22N2O2 and molecular weight 262.16812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-(4-phenylpyrrolidin-3-yl)carbamate
Also Known As: tert-butyl 4-phenylpyrrolidin-3-ylcarbamate, Tert-butyl N-(4-phenylpyrrolidin-3-yl)carbamate, Piperidone-4-propylenketal, tert-Butyl (3S,4R)-4-phenylpyrrolidin-3-ylcarbamate, tert-butyl N-[(3S,4R)-4-phenylpyrrolidin-3-yl]carbamate
Technical Specifications
| Molecular Formula | C15H22N2O2 |
| Molecular Weight | 262.16812 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.16812 Da |
| Heavy Atoms | 19 |
| Complexity | 306.0 |
| SMILES | CC(C)(C)OC(=O)NC1CNCC1C2=CC=CC=C2 |
| InChIKey | OQKMVLIVAWGYRD-UHFFFAOYSA-N |
Chemical Property Profile of Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate
Property Insights of Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate. With a topological polar surface area (TPSA) of 50.4 Ų, Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate?
The CAS number of Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate is 1015070-53-7.
What is the molecular formula of Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate?
The molecular formula of Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate is C15H22N2O2.
What is the molecular weight of Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate?
The molecular weight of Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate is 262.16812 g/mol.
Where can I buy Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate?
You can request a quote for Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate?
Yes, CoreyChem provides custom synthesis services for Tert-butyl 4-phenylpyrrolidin-3-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.