![2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane structure](/static/products/1029/1029712-59-1.webp)
2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane
TL;DR: 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane (CAS 1029712-59-1) is a chemical compound with molecular formula C11H13FN2 and molecular weight 192.10628 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane
Also Known As: 2-(3-fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane, 6-(3-fluorophenyl)-3,6-diazabicyclo[2.2.1]heptane, 2-(3-Fluoro-phenyl)-2,5-diaza-bicyclo[2.2.1]heptane, F30614
Technical Specifications
| Molecular Formula | C11H13FN2 |
| Molecular Weight | 192.10628 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.10628 Da |
| Heavy Atoms | 14 |
| Complexity | 221.0 |
| SMILES | C1C2CNC1CN2C3=CC(=CC=C3)F |
| InChIKey | NLGZBEQXRSLWNZ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane
Property Insights of 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane. With a topological polar surface area (TPSA) of 15.3 Ų, 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane has 1 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 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane?
The CAS number of 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane is 1029712-59-1.
What is the molecular formula of 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane?
The molecular formula of 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane is C11H13FN2.
What is the molecular weight of 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane?
The molecular weight of 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane is 192.10628 g/mol.
Where can I buy 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane?
You can request a quote for 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane?
Yes, CoreyChem provides custom synthesis services for 2-(3-Fluorophenyl)-2,5-diazabicyclo[2.2.1]heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.