General Information of the Compound
Compound ID
CP0375231
Compound Name
N-phenylspiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide
    Show/Hide
Structure
Formula
C20H22N2O2
Molecular Weight
322.408
Canonical SMILES
O=C(Nc1ccccc1)N1CCC2(CC1)CCc1ccccc1O2
    Show/Hide
InChI
InChI=1S/C20H22N2O2/c23-19(21-17-7-2-1-3-8-17)22-14-12-20(13-15-22)11-10-16-6-4-5-9-18(16)24-20/h1-9H,10-15H2,(H,21,23)
    Show/Hide
InChIKey
RHKNKIIFFZIDNY-UHFFFAOYSA-N
Physicochemical Property
logP
4.0783
Rotatable Bonds
1
Heavy Atom Count
24
Polar Areas
41.57
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
24

"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
CID: 71801263
ChEMBL ID
CHEMBL2443080
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
Protein ID: PT03065, Transient receptor potential cation channel subfamily M member 8
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 2423 nM
   TI
   LI
   LO
   TS