Home Other Building Blocks N-(1H-pyrazol-4-yl)acetamide

N-(1H-pyrazol-4-yl)acetamide

CAS No.:
6647-92-3
Catalog Number:
AG01AUYD
Molecular Formula:
C5H7N3O
Molecular Weight:
125.1286
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Product Description
Catalog Number:
AG01AUYD
Chemical Name:
N-(1H-pyrazol-4-yl)acetamide
CAS Number:
6647-92-3
Molecular Formula:
C5H7N3O
Molecular Weight:
125.1286
MDL Number:
MFCD12194780
IUPAC Name:
N-(1H-pyrazol-4-yl)acetamide
InChI:
InChI=1S/C5H7N3O/c1-4(9)8-5-2-6-7-3-5/h2-3H,1H3,(H,6,7)(H,8,9)
InChI Key:
XVFATADJUMUMNW-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1c[nH]nc1
Properties
Complexity:
115  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.059g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
125.131g/mol
Monoisotopic Mass:
125.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties