![1-(吡啶-3-基)双环[2.2.2]辛-4-胺 structure](/static/products/3129/31293-00-2.webp)
1-(吡啶-3-基)双环[2.2.2]辛-4-胺
TL;DR: 1-(吡啶-3-基)双环[2.2.2]辛-4-胺 (CAS 31293-00-2) is a chemical compound with molecular formula C13H18N2 and molecular weight 202.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(吡啶-3-基)双环[2.2.2]辛-4-胺
4-pyridin-3-ylbicyclo[2.2.2]octan-1-amine
Also Known As: 1-pyridin-3-ylbicyclo[2.2.2]octan-4-amine, Pyridine, 3-(4-aminobicyclo(2.2.2)oct-1-yl)-, 4-(3-Pyridyl)bicyclo(2.2.2)octane-1-amine, Bicyclo(2.2.2)octan-1-amine, 4-(3-pyridinyl)-, 4-(pyridin-3-yl)bicyclo[2.2.2]octan-1-amine
| Molecular Formula | C13H18N2 |
|---|---|
| Molecular Weight | 202.15 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 38.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.147 |
| Heavy Atoms | 15 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 31293-00-2 |
|---|---|
| SMILES | C1CC2(CCC1(CC2)C3=CN=CC=C3)N |
| InChIKey | UVTMQHPIJYGFGK-UHFFFAOYSA-N |
Product Overview
1-(吡啶-3-基)双环[2.2.2]辛-4-胺 (CAS 31293-00-2), with molecular formula C13H18N2 and molecular weight 202.15 g/mol. IUPAC: 4-pyridin-3-ylbicyclo[2.2.2]octan-1-amine.
Chemical Property Profile of 1-(吡啶-3-基)双环[2.2.2]辛-4-胺
Property Insights of 1-(吡啶-3-基)双环[2.2.2]辛-4-胺
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(吡啶-3-基)双环[2.2.2]辛-4-胺. With a topological polar surface area (TPSA) of 38.9 Ų, 1-(吡啶-3-基)双环[2.2.2]辛-4-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-吡啶-3-基双环[2.2.2]辛-4-胺 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
Frequently Asked Questions
What is the CAS number of 1-吡啶-3-基双环[2.2.2]辛-4-胺?
The CAS number of 1-吡啶-3-基双环[2.2.2]辛-4-胺 is 31293-00-2.
What is the molecular formula of 1-吡啶-3-基双环[2.2.2]辛-4-胺?
The molecular formula of 1-吡啶-3-基双环[2.2.2]辛-4-胺 is C13H18N2.
What is the molecular weight of 1-吡啶-3-基双环[2.2.2]辛-4-胺?
The molecular weight of 1-吡啶-3-基双环[2.2.2]辛-4-胺 is 202.15 g/mol.
Where can I buy 1-吡啶-3-基双环[2.2.2]辛-4-胺?
You can request a quote for 1-吡啶-3-基双环[2.2.2]辛-4-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-吡啶-3-基双环[2.2.2]辛-4-胺?
Yes, KEHONG BIO provides custom synthesis services for 1-吡啶-3-基双环[2.2.2]辛-4-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.