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Ribociclib Impurity 27

CAT: 1596-AR-R10888-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-R10888-02Size:25 Units
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CAS Number
119285-06-2
Synonyms
6- (Piperazin-1-yl) pyridin-3-amine
Molecular Formula
C9H14N4
Molecular Weight
178.24
API Name
Ribociclib

Chemical Information

6-(Piperazin-1-YL)pyridin-3-amine
CAS Number119285-06-2
PubChem CID24253241
IUPAC Name6-piperazin-1-ylpyridin-3-amine
Molecular FormulaC9H14N4
Molecular Weight178.23
XLogP0
Topological Polar Surface Area54.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity156
SMILES
C1CN(CCN1)C2=NC=C(C=C2)N
InChI
InChI=1S/C9H14N4/c10-8-1-2-9(12-7-8)13-5-3-11-4-6-13/h1-2,7,11H,3-6,10H2
InChIKey
MPEVPWUEDJNVHE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-(Piperazin-1-YL)pyridin-3-amine
CAS: 119285-06-2
CID: 24253241
Formula: C9H14N4
MW: 178.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight178.23
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass178.121846464
Monoisotopic Mass178.121846464
Topological Polar Surface Area54.2 Ų
Heavy Atom Count13
Formal Charge0
Complexity156
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes