General Information of the Compound
Compound ID
CP0849227
Compound Name
2-amino-N-(2-phenoxyphenyl)acetamide
    Show/Hide
Structure
Formula
C14H14N2O2
Molecular Weight
242.278
Canonical SMILES
NCC(=O)Nc1ccccc1Oc1ccccc1
    Show/Hide
InChI
InChI=1S/C14H14N2O2/c15-10-14(17)16-12-8-4-5-9-13(12)18-11-6-2-1-3-7-11/h1-9H,10,15H2,(H,16,17)
    Show/Hide
InChIKey
IEROOQILFMDTCS-UHFFFAOYSA-N
Physicochemical Property
logP
2.3761
Rotatable Bonds
4
Heavy Atom Count
18
Polar Areas
64.35
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
18

"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: 770500
ChEMBL ID
CHEMBL3588909
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: PT01598, Alpha-2C adrenergic receptor
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1 Cricetulus griseus (Chinese hamster)  2
1
EC50 = 630957.34 nM
   TI
   LI
   LO
   TS
2
Ki = 15488.17 nM
   TI
   LI
   LO
   TS