Home Other Building Blocks 5-Methoxy-N-phenylnicotinamide

5-Methoxy-N-phenylnicotinamide

CAS No.:
1138443-84-1
Catalog Number:
AG0090PG
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
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Product Description
Catalog Number:
AG0090PG
Chemical Name:
5-Methoxy-N-phenylnicotinamide
CAS Number:
1138443-84-1
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
IUPAC Name:
5-methoxy-N-phenylpyridine-3-carboxamide
InChI:
InChI=1S/C13H12N2O2/c1-17-12-7-10(8-14-9-12)13(16)15-11-5-3-2-4-6-11/h2-9H,1H3,(H,15,16)
InChI Key:
JCZHMRPQYHZDCK-UHFFFAOYSA-N
SMILES:
COc1cncc(c1)C(=O)Nc1ccccc1
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.09g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.251g/mol
Monoisotopic Mass:
228.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties