2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine
TL;DR: 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine (CAS 603068-87-7) is a chemical compound with molecular formula C16H25N and molecular weight 231.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-tert-butyl-5-methylphenyl)-4-methylpyrrolidine
Also Known As: 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine, 2-(3-tert-butyl-5-methylphenyl)-4-methylpyrrolidine, 4-methyl-2-(3-methyl-5-tert-butyl-phenyl)pyrrolidine, 4-Methyl-2-[3-methyl-5-(2-methyl-2-propanyl)phenyl]pyrrolidine, Pyrrolidine, 2-[3-(1,1-dimethylethyl)-5-methylphenyl]-4-methyl- (9CI)
| Molecular Formula | C16H25N |
|---|---|
| Molecular Weight | 231.20 g/mol |
| LogP | 3.96302 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.1987 |
| Heavy Atoms | 17 |
| Complexity | 400.47647 |
Chemical Identifiers
| CAS Number | 603068-87-7 |
|---|---|
| SMILES | CC1CC(NC1)C2=CC(=CC(=C2)C)C(C)(C)C |
Product Overview
2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine (CAS 603068-87-7), with molecular formula C16H25N and molecular weight 231.20 g/mol. IUPAC: 2-(3-tert-butyl-5-methylphenyl)-4-methylpyrrolidine.
Chemical Property Profile of 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine
Property Insights of 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine
The XLogP value of 3.96302 indicates that 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine?
The CAS number of 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine is 603068-87-7.
What is the molecular formula of 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine?
The molecular formula of 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine is C16H25N.
What is the molecular weight of 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine?
The molecular weight of 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine is 231.20 g/mol.
Where can I buy 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine?
You can request a quote for 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-(tert-Butyl)-5-methylphenyl)-4-methylpyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.