N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide
TL;DR: N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide (CAS 100966-82-3) is a chemical compound with molecular formula C14H23NO2 and molecular weight 237.17288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-4,6,6-trimethyl-2-oxocyclohex-3-ene-1-carboxamide
Also Known As: N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide, J1.758.629G, N,N-diethyl-4,6,6-trimethyl-2-oxocyclohex-3-ene-1-carboxamide, N,N-diethyl-4,6,6-trimethyl-2-oxo-cyclohex-3-ene-1-carboxamide, 654-781-3
Technical Specifications
| Molecular Formula | C14H23NO2 |
| Molecular Weight | 237.17288 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.17288 Da |
| Heavy Atoms | 17 |
| Complexity | 351.0 |
| SMILES | CCN(CC)C(=O)C1C(=O)C=C(CC1(C)C)C |
| InChIKey | NFAHDHNTWDSMQO-UHFFFAOYSA-N |
Chemical Property Profile of N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide
Property Insights of N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide. With a topological polar surface area (TPSA) of 37.4 Ų, N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide has 0 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 N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide?
The CAS number of N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide is 100966-82-3.
What is the molecular formula of N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide?
The molecular formula of N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide is C14H23NO2.
What is the molecular weight of N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide?
The molecular weight of N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide is 237.17288 g/mol.
Where can I buy N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide?
You can request a quote for N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide?
Yes, CoreyChem provides custom synthesis services for N,N-Diethyl-2-oxo-4,6,6-trimethyl-3-cyclohexene-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.