Home Other Building Blocks 3-Pyridinecarboxamide, N-phenyl-

3-Pyridinecarboxamide, N-phenyl-

CAS No.:
1752-96-1
Catalog Number:
AG0020EP
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
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Product Description
Catalog Number:
AG0020EP
Chemical Name:
3-Pyridinecarboxamide, N-phenyl-
CAS Number:
1752-96-1
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
MDL Number:
MFCD00023572
IUPAC Name:
N-phenylpyridine-3-carboxamide
InChI:
InChI=1S/C12H10N2O/c15-12(10-5-4-8-13-9-10)14-11-6-2-1-3-7-11/h1-9H,(H,14,15)
InChI Key:
NYQXIOZBHWFCBU-UHFFFAOYSA-N
SMILES:
O=C(c1cccnc1)Nc1ccccc1
EC Number:
217-138-4
NSC Number:
108206
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.225g/mol
Monoisotopic Mass:
198.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Effects of encapsulated niacin on metabolism and production of periparturient dairy cows. Journal of dairy science 20111001
Design of novel N-phenylnicotinamides as selective cyclooxygenase-1 inhibitors. Bioorganic & medicinal chemistry letters 20110101
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Inhibitors of inflammation and endogenous surfactant pool size as modulators of lung injury with initiation of ventilation in preterm sheep. Respiratory research 20100101
N-Phenyl-nicotinamide. Acta crystallographica. Section E, Structure reports online 20090301
Identification of aquaporin 4 inhibitors using in vitro and in silico methods. Bioorganic & medicinal chemistry 20090101
14N NQR study of nicotinamide and related compounds. Magnetic resonance in chemistry : MRC 20080101
Harnessing the wealth of Chinese scientific literature: schistosomiasis research and control in China. Emerging themes in epidemiology 20080101
Molluscicidal effect of nicotinanilide and its intermediate compounds against a freshwater snail Lymnaea luteola, the vector of animal schistosomiasis. Memorias do Instituto Oswaldo Cruz 20040301
Nicotinanilides as inhibitors of neutrophil chemotaxis. Bioorganic & medicinal chemistry letters 20020603
Properties