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3-iodo-N-phenylpyridine-2-carboxamide

3-iodo-N-phenylpyridine-2-carboxamide

CAS: 57841-90-4

Formula: C12H9IN2O

SMILES: IC1=CC=CN=C1C(=O)NC1=CC=CC=C1

IUPAC: 3-iodo-N-phenylpyridine-2-carboxamide

InChI: InChI=1S/C12H9IN2O/c13-10-7-4-8-14-11(10)12(16)15-9-5-2-1-3-6-9/h1-8H,(H,15,16)

Composition: C (44.47%), H (2.80%), I (39.15%), N (8.64%), O (4.94%)

Molar Mass: 324.121

Atom Count: 25

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 323.97596
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey DZJRPHHTMVPHBE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.43
Topological Polar Surface Area 41.99
Polarizability 27.16
Ring Count 2
Rotatable Bond Count 2

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