![3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one structure](/static/products/2703/27032-09-3.webp)
3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one
TL;DR: 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one (CAS 27032-09-3) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(3,4-dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one
Also Known As: 3-[2-(3,4-dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one, 3-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}cyclohex-2-en-1-one
Technical Specifications
| Molecular Formula | C16H21NO3 |
| Molecular Weight | 275.15213 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.15213 Da |
| Heavy Atoms | 20 |
| Complexity | 354.0 |
| SMILES | COC1=C(C=C(C=C1)CCNC2=CC(=O)CCC2)OC |
| InChIKey | ZRGUEBOECAIQTL-UHFFFAOYSA-N |
Chemical Property Profile of 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one
Property Insights of 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one. With a topological polar surface area (TPSA) of 47.6 Ų, 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one 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 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one?
The CAS number of 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one is 27032-09-3.
What is the molecular formula of 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one?
The molecular formula of 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one is C16H21NO3.
What is the molecular weight of 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one?
The molecular weight of 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one is 275.15213 g/mol.
Where can I buy 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one?
You can request a quote for 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for 3-[2-(3,4-Dimethoxyphenyl)ethylamino]cyclohex-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.