Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate
TL;DR: Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate (CAS 132994-04-8) is a chemical compound with molecular formula C12H15N3O2 and molecular weight 233.11642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate
Also Known As: ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate, 5,6,7,8-tetrahydro-2-amino-3-ethoxycarbonyl-1-cyanoindolizine, ETHYL2-AMINO-1-CYANO-5,6,7,8-TETRAHYDROINDOLIZINE-3-CARBOXYLATE, ethyl 2-amino-1-cyano-5,6,7,8-tetrahydro-3-indolizinecarboxylate, 2-amino-1-cyano-5,6,7,8-tetrahydro-indolizine-3-carboxylic acid ethyl ester
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H15N3O2 |
| Molecular Weight | 233.11642 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 81.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.11642 Da |
| Heavy Atoms | 17 |
| Complexity | 349.0 |
| SMILES | CCOC(=O)C1=C(C(=C2N1CCCC2)C#N)N |
| InChIKey | BLIODJPMVYMPJT-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate
Property Insights of Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate. The TPSA of 81.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate has 1 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 Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate?
The CAS number of Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate is 132994-04-8.
What is the molecular formula of Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate?
The molecular formula of Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate is C12H15N3O2.
What is the molecular weight of Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate?
The molecular weight of Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate is 233.11642 g/mol.
Where can I buy Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate?
You can request a quote for Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-amino-1-cyano-5,6,7,8-tetrahydroindolizine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.