General Information of the Compound
Compound ID
CP0184591
Compound Name
(E)-N-Hydroxy-3-phenyl-acrylamide
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Synonyms
2-Propenamide, N-hydroxy-3-phenyl-
2-Propenamide, N-hydroxy-3-phenyl-, (2E)-
2-Propenamide, N-hydroxy-3-phenyl-, (E)-
3669-32-7
434STJ4H11
AC1NS7U4
AC1Q5CS7
CHEMBL154574
CINNAMOHYDROXAMIC ACID
Cinnamohydroxamic acid, (E)-
Cinnamoylhydroxamic acid
Cinnamoylhydroxamic acid [INCI]
Hydroxylamine, N-cinnamoyl-
MAZ 1704
MAZ-1704
N-Hydroxy-3-phenyl-2-propenamide
N-Hydroxy-3-phenyl-acrylamide
N-Hydroxycinnamamide
NSC 42128
NSC 44617
NSC-42128
NSC-44617
SCHEMBL559917
UNII-434STJ4H11
WLN: QMV1U1R
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Structure
Formula
C9H9NO2
Molecular Weight
163.176
Canonical SMILES
ONC(=O)\C=C\c1ccccc1
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InChI
InChI=1S/C9H9NO2/c11-9(10-12)7-6-8-4-2-1-3-5-8/h1-7,12H,(H,10,11)/b7-6+
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InChIKey
UVDDFTZLVFIQFL-VOTSOKGWSA-N
CAS
3669-32-7
Physicochemical Property
logP
1.2052
Rotatable Bonds
2
Heavy Atom Count
12
Polar Areas
49.33
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
12

"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).

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PubChem ID
CID: 5355635
SID: 16520569
ChEMBL ID
CHEMBL154574
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: PT01743, Polyunsaturated fatty acid 5-lipoxygenase
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000194 RBL-1 Rattus norvegicus (Rat)  1
1
IC50 = 12000 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( N-Hydroxy-3-phenyl-acrylamide )
Drug Name N-Hydroxy-3-phenyl-acrylamide
Target(s)
Arachidonate 5-lipoxygenase (5-LOX)
Inhibitor