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247583-80-8 | 1H-Pyrazole-3-carboxamide, 4-amino-5-ethyl-1-methyl-
CAS No: 247583-80-8 Catalog No: AG002PCG MDL No:MFCD04115072
Product Description
Catalog Number:
AG002PCG
Chemical Name:
1H-Pyrazole-3-carboxamide, 4-amino-5-ethyl-1-methyl-
CAS Number:
247583-80-8
Molecular Formula:
C7H12N4O
Molecular Weight:
168.1964
MDL Number:
MFCD04115072
IUPAC Name:
4-amino-5-ethyl-1-methylpyrazole-3-carboxamide
InChI:
InChI=1S/C7H12N4O/c1-3-4-5(8)6(7(9)12)10-11(4)2/h3,8H2,1-2H3,(H2,9,12)
InChI Key:
ZVVNGCZZXMLAOA-UHFFFAOYSA-N
SMILES:
CCc1n(C)nc(c1N)C(=O)N
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.101g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.2g/mol
Monoisotopic Mass:
168.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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