6-(4-methoxyphenyl)-N-(2-methylpropyl)hexa-2,4-dienamide

Details

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Internal ID 49e83dba-1c34-4c7a-9f9d-739ae34989c2
Taxonomy Benzenoids > Phenol ethers > Anisoles
IUPAC Name 6-(4-methoxyphenyl)-N-(2-methylpropyl)hexa-2,4-dienamide
SMILES (Canonical) CC(C)CNC(=O)C=CC=CCC1=CC=C(C=C1)OC
SMILES (Isomeric) CC(C)CNC(=O)C=CC=CCC1=CC=C(C=C1)OC
InChI InChI=1S/C17H23NO2/c1-14(2)13-18-17(19)8-6-4-5-7-15-9-11-16(20-3)12-10-15/h4-6,8-12,14H,7,13H2,1-3H3,(H,18,19)
InChI Key IHRWUVSXOBLEJV-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C17H23NO2
Molecular Weight 273.37 g/mol
Exact Mass 273.172878976 g/mol
Topological Polar Surface Area (TPSA) 38.30 Ų
XlogP 3.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 6-(4-methoxyphenyl)-N-(2-methylpropyl)hexa-2,4-dienamide

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 97.35% 96.09%
CHEMBL2581 P07339 Cathepsin D 95.98% 98.95%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.14% 91.11%
CHEMBL3060 Q9Y345 Glycine transporter 2 92.23% 99.17%
CHEMBL3492 P49721 Proteasome Macropain subunit 91.11% 90.24%
CHEMBL4208 P20618 Proteasome component C5 90.75% 90.00%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 90.26% 94.45%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 89.62% 95.56%
CHEMBL221 P23219 Cyclooxygenase-1 88.00% 90.17%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 87.91% 96.00%
CHEMBL3401 O75469 Pregnane X receptor 86.70% 94.73%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 86.34% 95.50%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 84.33% 97.29%
CHEMBL2535 P11166 Glucose transporter 81.84% 98.75%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Piper callosum
Piper corcovadense
Piper ovatum
Piper scutifolium

Cross-Links

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PubChem 161479
LOTUS LTS0074984
wikiData Q104168803