Home Nitriles 5-amino-4-methyl-1-(pyridin-3-yl)-1H-pyrazole-3-carbonitrile

5-amino-4-methyl-1-(pyridin-3-yl)-1H-pyrazole-3-carbonitrile

CAS No.:
1803609-64-4
Catalog Number:
AG01AL93
Molecular Formula:
C10H9N5
Molecular Weight:
199.2120
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Product Description
Catalog Number:
AG01AL93
Chemical Name:
5-amino-4-methyl-1-(pyridin-3-yl)-1H-pyrazole-3-carbonitrile
CAS Number:
1803609-64-4
Molecular Formula:
C10H9N5
Molecular Weight:
199.2120
MDL Number:
MFCD28968185
IUPAC Name:
5-amino-4-methyl-1-pyridin-3-ylpyrazole-3-carbonitrile
InChI:
InChI=1S/C10H9N5/c1-7-9(5-11)14-15(10(7)12)8-3-2-4-13-6-8/h2-4,6H,12H2,1H3
InChI Key:
OAEWBOSXVQAOGM-UHFFFAOYSA-N
SMILES:
N#Cc1nn(c(c1C)N)c1cccnc1
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.086g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.217g/mol
Monoisotopic Mass:
199.086g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties