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]+ 181.108376 140.3
[M+Na]+ 203.090318 150.2
[M-H]- 179.093824 145.4
[M+NH4]+ 198.134923 154.1
[M+K]+ 219.064258 146.1
[M+H-H2O]+ 163.098360 132.7
[M+HCOO]- 225.099301 164.5
[M+CH3COO]- 239.114951 188.2
[M+Na-2H]- 201.075766 144.1
[M]+ 180.10055142 141.1
[M]- 180.10164858 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.