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  • [Synonyms]
    BRN 0518333
    4-(Isopropylamino)-1-(3-pyridyl)pyrazole
    3-(4-(Isopropylamino)pyrazol-1-yl)pyridine
    Pyrazole, 4-(isopropylamino)-1-(3-pyridyl)-
    LS-131653
    Pyridine, 3-(4-(isopropylamino)pyrazol-1-yl)-
    5-25-09-00434 (Beilstein Handbook Reference)
    28466-02-6

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight202.25566 [g/mol]
    Molecular FormulaC11H14N4
    XLogP1.8
    H-Bond Donor1
    H-Bond Acceptor4
    Rotatable Bond Count3
    Exact Mass202.121846
    MonoIsotopic Mass202.121846
    Topological Polar Surface Area42.7
    Heavy Atom Count15
    Formal Charge0
    Complexity195
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: N-propan-2-yl-1-pyridin-3-ylpyrazol-4-amine
    Canonical SMILES: CC(C)NC1=CN(N=C1)C2=CN=CC=C2
    InChI: InChI=1/C11H14N4/c1-9(2)14-10-6-13-15(8-10)11-4-3-5-12-7-11/h3-9,14H,
    1-2H3



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