2-(1-Methylethenyl)-5-(1-methylethyl)pyrazine

Details

• Internal ID: 1c0215f5-1a57-4473-81a9-e5a871bfaf59
• Taxonomy: Organoheterocyclic compounds > Diazines > Pyrazines
• IUPAC Name: 2-propan-2-yl-5-prop-1-en-2-ylpyrazine
• InChI: InChI=1S/C10H14N2/c1-7(2)9-5-12-10(6-11-9)8(3)4/h5-6,8H,1H2,2-4H3
• InChI Key: RVKVUYGBDYOOJD-UHFFFAOYSA-N
• Popularity: 4 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₀H₁₄N₂
• Molecular Weight: 162.23 g/mol
• Exact Mass: 162.115698455 g/mol
• Topological Polar Surface Area (TPSA): 25.80 Ų
• XlogP: 2.40

Synonyms

• 704909-07-9
• SCHEMBL16432992
• RVKVUYGBDYOOJD-UHFFFAOYSA-
• CHEBI:204064
• RVKVUYGBDYOOJD-UHFFFAOYSA-N
• 2-propan-2-yl-5-prop-1-en-2-ylpyrazine
• DB-289022
• Pyrazine, 2-(1-methylethenyl)-5-(1-methylethyl)-
• InChI=1/C10H14N2/c1-7(2)9-5-12-10(6-11-9)8(3)4/h5-6,8H,1H2,2-4H3

2D Structure

ADMET Properties (via admetSAR 2)

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

Targets

Proven Targets:

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	90.76%	96.09%
CHEMBL3401	O75469	Pregnane X receptor	84.80%	94.73%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	83.07%	94.45%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	81.16%	91.11%
CHEMBL2039	P27338	Monoamine oxidase B	80.90%	92.51%
CHEMBL2107	P61073	C-X-C chemokine receptor type 4	80.62%	93.10%
CHEMBL3492	P49721	Proteasome Macropain subunit	80.32%	90.24%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 11528402
• LOTUS: LTS0197709
• wikiData: Q77383450