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89239-76-9 | Acetamide, N-(5-cyano-3-methyl-1-propyl-1H-pyrazol-4-yl)-
CAS No: 89239-76-9 Catalog No: AG00432R MDL No:
Product Description
Catalog Number:
AG00432R
Chemical Name:
Acetamide, N-(5-cyano-3-methyl-1-propyl-1H-pyrazol-4-yl)-
CAS Number:
89239-76-9
Molecular Formula:
C10H14N4O
Molecular Weight:
206.2444
IUPAC Name:
N-(5-cyano-3-methyl-1-propylpyrazol-4-yl)acetamide
InChI:
InChI=1S/C10H14N4O/c1-4-5-14-9(6-11)10(7(2)13-14)12-8(3)15/h4-5H2,1-3H3,(H,12,15)
InChI Key:
HMWSFFUPLJWSTA-UHFFFAOYSA-N
SMILES:
CCCn1nc(c(c1C#N)NC(=O)C)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.117g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.249g/mol
Monoisotopic Mass:
206.117g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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