General Information of the Compound
| Compound ID |
CP0499080
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-benzyl-N-[2-(4-fluorophenyl)-2-methylpropyl]piperidine-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H29FN2O
|
||||||||||||||||||
| Molecular Weight |
368.496
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(CNC(=O)C1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H29FN2O/c1-23(2,20-8-10-21(24)11-9-20)17-25-22(27)19-12-14-26(15-13-19)16-18-6-4-3-5-7-18/h3-11,19H,12-17H2,1-2H3,(H,25,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ISTBVQBRNDWPGP-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