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CHEBI:190559 - (5-methyl-3-isoxazolyl)[4-(5-propyl-2-pyrimidinyl)piperazino]methanone

ChEBI IDCHEBI:190559
ChEBI Name(5-methyl-3-isoxazolyl)[4-(5-propyl-2-pyrimidinyl)piperazino]methanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H21N5O2
Net Charge0
Average Mass315.377
Monoisotopic Mass315.16952
SMILESCCCc1cnc(N2CCN(C(=O)c3cc(C)on3)CC2)nc1
InChIInChI=1S/C16H21N5O2/c1-3-4-13-10-17-16(18-11-13)21-7-5-20(6-8-21)15(22)14-9-12(2)23-19-14/h9-11H,3-8H2,1-2H3
InChIKeyNSZVFAGWJYIOAD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) liver (BTO:0000759) MetaboLights (MTBLS4163)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
(5-methyl-3-isoxazolyl)[4-(5-propyl-2-pyrimidinyl)piperazino]methanone (CHEBI:190559) is a N-arylpiperazine (CHEBI:46848)
IUPAC Name 
(5-methyl-1,2-oxazol-3-yl)-[4-(5-propylpyrimidin-2-yl)piperazin-1-yl]methanone
Manual XrefsDatabases
2091106ChemSpider