![3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid structure](/static/products/100/1005246-12-7.webp)
3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
TL;DR: 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid (CAS 1005246-12-7) is a chemical compound with molecular formula C16H18N2O3 and molecular weight 286.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(pyridin-3-ylmethylcarbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Also Known As: 2-(pyridin-3-ylmethylcarbamoyl)bicyclo[2.2.2]oct-5-ene-3-carboxylic acid, 3-[N-(3-pyridylmethyl)carbamoyl]bicyclo[2.2.2]oct-5-ene-2-carboxylic acid, 7-(pyridin-3-ylmethylcarbamoyl)bicyclo[2.2.2]oct-2-ene-8-carboxylic Acid, 3-((pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid, 3-[(pyridin-3-ylmethyl)carbamoyl]bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Technical Specifications
| Molecular Formula | C16H18N2O3 |
| Molecular Weight | 286.13174 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 79.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.13174 Da |
| Heavy Atoms | 21 |
| Complexity | 449.0 |
| SMILES | C1CC2C=CC1C(C2C(=O)O)C(=O)NCC3=CN=CC=C3 |
| InChIKey | OHUIMECECYWTRW-UHFFFAOYSA-N |
Chemical Property Profile of 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Property Insights of 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid. Following Lipinski's Rule of Five, 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid?
The CAS number of 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid is 1005246-12-7.
What is the molecular formula of 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid?
The molecular formula of 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid is C16H18N2O3.
What is the molecular weight of 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid?
The molecular weight of 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid is 286.13174 g/mol.
Where can I buy 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid?
You can request a quote for 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 3-((Pyridin-3-ylmethyl)carbamoyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.