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A1H95

Summary
Name:(3~{R})-3-methyl-1-(6-methylpyridin-2-yl)piperazine
Formula:C11 H17 N3
Formal charge:0
Formula weight:191.273 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(3~{R})-3-methyl-1-(6-methylpyridin-2-yl)piperazine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C11H17N3/c1-9-4-3-5-11(13-9)14-7-6-12-10(2)8-14/h3-5,10,12H,6-8H2,1-2H3/t10-/m1/s1
InChIKeyInChI1.06YCMYTWGABUXSEI-SNVBAGLBSA-N
SMILES_CANONICALCACTVS3.385C[C@@H]1CN(CCN1)c2cccc(C)n2
SMILESCACTVS3.385C[CH]1CN(CCN1)c2cccc(C)n2
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1cccc(n1)N2CCN[C@@H](C2)C
SMILESOpenEye OEToolkits2.0.7Cc1cccc(n1)N2CCNC(C2)C

223166

PDB entries from 2024-07-31

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