![1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine structure](/static/products/102/1026297-62-0.webp)
1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine
TL;DR: 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine (CAS 1026297-62-0) is a chemical compound with molecular formula C14H20N2 and molecular weight 216.16264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine
Also Known As: 7-benzyl-5,7-diazabicyclo[4.3.0]nonane, 1-benzyloctahydro-1h-pyrrolo[2,3-b]pyridine
Technical Specifications
| Molecular Formula | C14H20N2 |
| Molecular Weight | 216.16264 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.16264 Da |
| Heavy Atoms | 16 |
| Complexity | 223.0 |
| SMILES | C1CC2CCN(C2NC1)CC3=CC=CC=C3 |
| InChIKey | WKCRLKQMMQUBSB-UHFFFAOYSA-N |
Chemical Property Profile of 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine
Property Insights of 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine. With a topological polar surface area (TPSA) of 15.3 Ų, 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine?
The CAS number of 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine is 1026297-62-0.
What is the molecular formula of 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine?
The molecular formula of 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine is C14H20N2.
What is the molecular weight of 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine?
The molecular weight of 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine is 216.16264 g/mol.
Where can I buy 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine?
You can request a quote for 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine?
Yes, CoreyChem provides custom synthesis services for 1-Benzyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[2,3-b]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.