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88561-45-9 | 2,6-Pyridinedicarboxamide, 4-(cyclopropylamino)-N,N'-dimethyl-
CAS No: 88561-45-9 Catalog No: AG004E2M MDL No:
Product Description
Catalog Number:
AG004E2M
Chemical Name:
2,6-Pyridinedicarboxamide, 4-(cyclopropylamino)-N,N'-dimethyl-
CAS Number:
88561-45-9
Molecular Formula:
C12H16N4O2
Molecular Weight:
248.2810
IUPAC Name:
4-(cyclopropylamino)-2-N,6-N-dimethylpyridine-2,6-dicarboxamide
InChI:
InChI=1S/C12H16N4O2/c1-13-11(17)9-5-8(15-7-3-4-7)6-10(16-9)12(18)14-2/h5-7H,3-4H2,1-2H3,(H,13,17)(H,14,18)(H,15,16)
InChI Key:
JGBQDGDADMSBJE-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cc(NC2CC2)cc(n1)C(=O)NC
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.127g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
248.286g/mol
Monoisotopic Mass:
248.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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