General Information of the Compound
| Compound ID |
CP0102470
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2,2-dimethyl-N-(4-methyl-3-(morpholinomethyl)phenyl)butanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H28N2O2
|
||||||||||||||||||
| Molecular Weight |
304.434
|
||||||||||||||||||
| Canonical SMILES |
CCC(C)(C)C(=O)Nc1ccc(C)c(CN2CCOCC2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H28N2O2/c1-5-18(3,4)17(21)19-16-7-6-14(2)15(12-16)13-20-8-10-22-11-9-20/h6-7,12H,5,8-11,13H2,1-4H3,(H,19,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OMZGWMWVQIYTFO-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound