Home Aminos 2-(3-amino-1H-1,2,4-triazol-1-yl)-N-methylacetamide

2-(3-amino-1H-1,2,4-triazol-1-yl)-N-methylacetamide

CAS No.:
1182757-96-5
Catalog Number:
AG019S0S
Molecular Formula:
C5H9N5O
Molecular Weight:
155.1579
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Product Description
Catalog Number:
AG019S0S
Chemical Name:
2-(3-amino-1H-1,2,4-triazol-1-yl)-N-methylacetamide
CAS Number:
1182757-96-5
Molecular Formula:
C5H9N5O
Molecular Weight:
155.1579
MDL Number:
MFCD12804840
IUPAC Name:
2-(3-amino-1,2,4-triazol-1-yl)-N-methylacetamide
InChI:
InChI=1S/C5H9N5O/c1-7-4(11)2-10-3-8-5(6)9-10/h3H,2H2,1H3,(H2,6,9)(H,7,11)
InChI Key:
SFTQAHBRUGJKHE-UHFFFAOYSA-N
SMILES:
CNC(=O)Cn1cnc(n1)N
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.081g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
155.161g/mol
Monoisotopic Mass:
155.081g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties