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4-(dimethylamino)-2-[(2-fluorophenyl)amino]pyridine-3-carbonitrile

4-(dimethylamino)-2-[(2-fluorophenyl)amino]pyridine-3-carbonitrile

CAS: 339102-33-9

Formula: C14H13FN4

SMILES: CN(C)C1=C(C#N)C(NC2=C(F)C=CC=C2)=NC=C1

IUPAC: 4-(dimethylamino)-2-[(2-fluorophenyl)amino]pyridine-3-carbonitrile

InChI: InChI=1S/C14H13FN4/c1-19(2)13-7-8-17-14(10(13)9-16)18-12-6-4-3-5-11(12)15/h3-8H,1-2H3,(H,17,18)

Composition: C (65.61%), H (5.11%), F (7.41%), N (21.86%)

Molar Mass: 256.284

Atom Count: 32

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 256.112424598
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey ZTWYGIIRAXGMAF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.07
Topological Polar Surface Area 51.95
Polarizability 26.48
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 339102-33-9 $51.35-$524.40$51.35$63.37$86.31$524.40
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