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89239-25-8 | 1H-Pyrazole-5-carboxamide, 4-(acetylamino)-1,3-dimethyl-
CAS No: 89239-25-8 Catalog No: AG00449S MDL No:MFCD20717656
Product Description
Catalog Number:
AG00449S
Chemical Name:
1H-Pyrazole-5-carboxamide, 4-(acetylamino)-1,3-dimethyl-
CAS Number:
89239-25-8
Molecular Formula:
C8H12N4O2
Molecular Weight:
196.2065
MDL Number:
MFCD20717656
IUPAC Name:
4-acetamido-2,5-dimethylpyrazole-3-carboxamide
InChI:
InChI=1S/C8H12N4O2/c1-4-6(10-5(2)13)7(8(9)14)12(3)11-4/h1-3H3,(H2,9,14)(H,10,13)
InChI Key:
DQZMTADDBWFDNL-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1c(C)nn(c1C(=O)N)C
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.096g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.21g/mol
Monoisotopic Mass:
196.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
90A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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