Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate
TL;DR: Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate (CAS 1212330-34-1) is a chemical compound with molecular formula C16H24N2O2 and molecular weight 276.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[4-(4-methylphenyl)pyrrolidin-3-yl]carbamate
Also Known As: tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate, N,N-Dimethyl-3-fluoroaniline, tert-Butyl (4-(p-tolyl)pyrrolidin-3-yl)carbamate, Tert-butyl N-[4-(4-methylphenyl)pyrrolidin-3-yl]carbamate, 7616AC
Technical Specifications
| Molecular Formula | C16H24N2O2 |
| Molecular Weight | 276.18378 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.18378 Da |
| Heavy Atoms | 20 |
| Complexity | 330.0 |
| SMILES | CC1=CC=C(C=C1)C2CNCC2NC(=O)OC(C)(C)C |
| InChIKey | KDBWMCGWFKBCFT-UHFFFAOYSA-N |
Chemical Property Profile of Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate
Property Insights of Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate. With a topological polar surface area (TPSA) of 50.4 Ų, Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl 4-p-tolylpyrrolidin-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-p-tolylpyrrolidin-3-ylcarbamate?
The CAS number of Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate is 1212330-34-1.
What is the molecular formula of Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate?
The molecular formula of Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate is C16H24N2O2.
What is the molecular weight of Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate?
The molecular weight of Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate is 276.18378 g/mol.
Where can I buy Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate?
You can request a quote for Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate?
Yes, CoreyChem provides custom synthesis services for Tert-butyl 4-p-tolylpyrrolidin-3-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.