Home Other Building Blocks 1-methyl-N-(prop-2-yn-1-yl)-1H-pyrazole-5-carboxamide

1-methyl-N-(prop-2-yn-1-yl)-1H-pyrazole-5-carboxamide

CAS No.:
1248172-02-2
Catalog Number:
AG01BJ0V
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
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Product Description
Catalog Number:
AG01BJ0V
Chemical Name:
1-methyl-N-(prop-2-yn-1-yl)-1H-pyrazole-5-carboxamide
CAS Number:
1248172-02-2
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
MDL Number:
MFCD14638368
IUPAC Name:
2-methyl-N-prop-2-ynylpyrazole-3-carboxamide
InChI:
InChI=1S/C8H9N3O/c1-3-5-9-8(12)7-4-6-10-11(7)2/h1,4,6H,5H2,2H3,(H,9,12)
InChI Key:
SZZUDOKRAJTFDC-UHFFFAOYSA-N
SMILES:
Cn1nccc1C(=O)NCC#C
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.075g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.18g/mol
Monoisotopic Mass:
163.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties