2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide
TL;DR: 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide (CAS 51838-00-7) is a chemical compound with molecular formula C12H20N2O and molecular weight 208.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide
Also Known As: Cyto3D6, Maybridge1_003110, 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide, N1-(3,3,5-trimethylcyclohexyl)-2-cyanoacetamide, ACETAMIDE,2-CYANO-N-(3,3,5-TRIMETHYLCYCLOHEXYL)-
| Molecular Formula | C12H20N2O |
|---|---|
| Molecular Weight | 208.16 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.15756 |
| Heavy Atoms | 15 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 51838-00-7 |
|---|---|
| SMILES | CC1CC(CC(C1)(C)C)NC(=O)CC#N |
| InChIKey | DOQDNMZNLGZKFI-UHFFFAOYSA-N |
Product Overview
2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide (CAS 51838-00-7), with molecular formula C12H20N2O and molecular weight 208.16 g/mol. IUPAC: 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide.
Chemical Property Profile of 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide
Property Insights of 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide
The XLogP value of 3.1 indicates that 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide 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 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide?
The CAS number of 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide is 51838-00-7.
What is the molecular formula of 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide?
The molecular formula of 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide is C12H20N2O.
What is the molecular weight of 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide?
The molecular weight of 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide is 208.16 g/mol.
Where can I buy 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide?
You can request a quote for 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-(3,3,5-trimethylcyclohexyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.