![3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one structure](/static/products/1022/1022391-08-7.webp)
3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one
TL;DR: 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one (CAS 1022391-08-7) is a chemical compound with molecular formula C16H22N2O and molecular weight 258.17322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-(dimethylamino)anilino]-5,5-dimethylcyclohex-2-en-1-one
Also Known As: 3-{[4-(dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one, 3-[4-(dimethylamino)anilino]-5,5-dimethylcyclohex-2-en-1-one, 3-((4-(DIMETHYLAMINO)PHENYL)AMINO)-5,5-DIMETHYLCYCLOHEX-2-EN-1-ONE, 3-[4-(dimethylamino)anilino]-5,5-dimethyl-2-cyclohexen-1-one, 3-[(4-dimethylaminophenyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one
Technical Specifications
| Molecular Formula | C16H22N2O |
| Molecular Weight | 258.17322 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.17322 Da |
| Heavy Atoms | 19 |
| Complexity | 363.0 |
| SMILES | CC1(CC(=CC(=O)C1)NC2=CC=C(C=C2)N(C)C)C |
| InChIKey | SFWMAECAGJABFJ-UHFFFAOYSA-N |
Chemical Property Profile of 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one
Property Insights of 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one
The XLogP value of 3.1 indicates that 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one has 1 hydrogen bond donor(s) and 3 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-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
The CAS number of 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one is 1022391-08-7.
What is the molecular formula of 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
The molecular formula of 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one is C16H22N2O.
What is the molecular weight of 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
The molecular weight of 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one is 258.17322 g/mol.
Where can I buy 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
You can request a quote for 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for 3-{[4-(Dimethylamino)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.