CID 80503163

5-amino-n-cyclopropyl-1-methyl-1h-pyrazole-4-carboxamide

Structural Information

Molecular Formula
C8H12N4O
SMILES
CN1C(=C(C=N1)C(=O)NC2CC2)N
InChI
InChI=1S/C8H12N4O/c1-12-7(9)6(4-10-12)8(13)11-5-2-3-5/h4-5H,2-3,9H2,1H3,(H,11,13)
InChIKey
OXCNMRNZAPREQZ-UHFFFAOYSA-N
Compound name
5-amino-N-cyclopropyl-1-methylpyrazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.1011 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.10838 140.3
[M+Na]+ 203.09032 150.2
[M-H]- 179.09382 145.4
[M+NH4]+ 198.13492 154.1
[M+K]+ 219.06426 146.1
[M+H-H2O]+ 163.09836 132.7
[M+HCOO]- 225.09930 164.5
[M+CH3COO]- 239.11495 188.2
[M+Na-2H]- 201.07577 144.1
[M]+ 180.10055 141.1
[M]- 180.10165 141.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.