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2-(piperazin-1-yl)pyridine-3-carbonitrile

2-(piperazin-1-yl)pyridine-3-carbonitrile

CAS: 84951-44-0

Formula: C10H12N4

SMILES: N#CC1=C(N=CC=C1)N1CCNCC1

IUPAC: 2-(piperazin-1-yl)pyridine-3-carbonitrile

InChI: InChI=1S/C10H12N4/c11-8-9-2-1-3-13-10(9)14-6-4-12-5-7-14/h1-3,12H,4-7H2

Composition: C (63.81%), H (6.43%), N (29.77%)

Molar Mass: 188.234

Atom Count: 26

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 188.106196402
Formal Charge 0
FSP3 0.4
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey QSMNQUURWIAXAA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.12
Topological Polar Surface Area 51.95
Polarizability 20.56
Ring Count 2
Rotatable Bond Count 1

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95% <2 Days 84951-44-0 $51.35-$90.68$51.35$60.09$63.37$86.31$90.68
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