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88561-27-7 | 4-Pyridinecarboxamide, N-(2-acetyl-4-methylphenyl)-
CAS No: 88561-27-7 Catalog No: AG004CAC MDL No:
Product Description
Catalog Number:
AG004CAC
Chemical Name:
4-Pyridinecarboxamide, N-(2-acetyl-4-methylphenyl)-
CAS Number:
88561-27-7
Molecular Formula:
C15H14N2O2
Molecular Weight:
254.2839
IUPAC Name:
N-(2-acetyl-4-methylphenyl)pyridine-4-carboxamide
InChI:
InChI=1S/C15H14N2O2/c1-10-3-4-14(13(9-10)11(2)18)17-15(19)12-5-7-16-8-6-12/h3-9H,1-2H3,(H,17,19)
InChI Key:
GSPOWAKRURWQCA-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C(=O)C)NC(=O)c1ccncc1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.289g/mol
Monoisotopic Mass:
254.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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