2-Cyano-2-cyclopentylideneethanethioamide
TL;DR: 2-Cyano-2-cyclopentylideneethanethioamide (CAS 129224-51-7) is a chemical compound with molecular formula C8H10N2S and molecular weight 166.05647 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyano-2-cyclopentylideneethanethioamide
Also Known As: 2-cyano-2-cyclopentylideneethanethioamide, cyclopentylidenecyanothioacetamide, Ethanethioamide, 2-cyano-2-cyclopentylidene-, cyanocyclopentylidene thioacetamide, Cyano(cyclopentylidene)ethanethioamide
Technical Specifications
| Molecular Formula | C8H10N2S |
| Molecular Weight | 166.05647 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 81.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.05647 Da |
| Heavy Atoms | 11 |
| Complexity | 249.0 |
| SMILES | C1CCC(=C(C#N)C(=S)N)C1 |
| InChIKey | CCXXZJAUUBAXIO-UHFFFAOYSA-N |
Chemical Property Profile of 2-Cyano-2-cyclopentylideneethanethioamide
Property Insights of 2-Cyano-2-cyclopentylideneethanethioamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-2-cyclopentylideneethanethioamide. The TPSA of 81.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-2-cyclopentylideneethanethioamide. Following Lipinski's Rule of Five, 2-Cyano-2-cyclopentylideneethanethioamide 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 2-Cyano-2-cyclopentylideneethanethioamide?
The CAS number of 2-Cyano-2-cyclopentylideneethanethioamide is 129224-51-7.
What is the molecular formula of 2-Cyano-2-cyclopentylideneethanethioamide?
The molecular formula of 2-Cyano-2-cyclopentylideneethanethioamide is C8H10N2S.
What is the molecular weight of 2-Cyano-2-cyclopentylideneethanethioamide?
The molecular weight of 2-Cyano-2-cyclopentylideneethanethioamide is 166.05647 g/mol.
Where can I buy 2-Cyano-2-cyclopentylideneethanethioamide?
You can request a quote for 2-Cyano-2-cyclopentylideneethanethioamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Cyano-2-cyclopentylideneethanethioamide?
Yes, CoreyChem provides custom synthesis services for 2-Cyano-2-cyclopentylideneethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.