TL;DR: N-(2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)phenyl)-2-methylpropanamide (CAS 104143-31-9) is a chemical compound with molecular formula C18H24N2O2 and molecular weight 300.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]phenyl]-2-methylpropanamide
Also Known As: N-(2-((5,5-DIMETHYL-3-OXOCYCLOHEX-1-ENYL)AMINO)PHENYL)-2-METHYLPROPANAMIDE, N-[2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]phenyl]-2-methylpropanamide, N-[2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]phenyl]-2-methyl-propanamide, N-[2-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]phenyl]-2-methyl-propanamide, N-{2-[(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-2-methylpropanamide
| Molecular Formula | C18H24N2O2 |
| Molecular Weight | 300.18378 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.18378 Da |
| Heavy Atoms | 22 |
| Complexity | 466.0 |
| SMILES | CC(C)C(=O)NC1=CC=CC=C1NC2=CC(=O)CC(C2)(C)C |
| InChIKey | JHDOGKAINWZJPS-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that N-(2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)phenyl)-2-methylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, N-(2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)phenyl)-2-methylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)phenyl)-2-methylpropanamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)phenyl)-2-methylpropanamide is 104143-31-9.
The molecular formula of N-(2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)phenyl)-2-methylpropanamide is C18H24N2O2.
The molecular weight of N-(2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)phenyl)-2-methylpropanamide is 300.18378 g/mol.
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