CID 1263609

5-amino-1-isopropyl-1h-pyrazole-4-carboxamide

Structural Information

Molecular Formula
C7H12N4O
SMILES
CC(C)N1C(=C(C=N1)C(=O)N)N
InChI
InChI=1S/C7H12N4O/c1-4(2)11-6(8)5(3-10-11)7(9)12/h3-4H,8H2,1-2H3,(H2,9,12)
InChIKey
CVWQIYNNOPJHPG-UHFFFAOYSA-N
Compound name
5-amino-1-propan-2-ylpyrazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

56
Patents

168.1011 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.10838 136.1
[M+Na]+ 191.09032 144.3
[M+NH4]+ 186.13492 142.1
[M+K]+ 207.06426 143.4
[M-H]- 167.09382 135.9
[M+Na-2H]- 189.07577 139.2
[M]+ 168.10055 136.6
[M]- 168.10165 136.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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