CID 2727413

5-amino-1-(4-fluorophenyl)-1h-pyrazole-4-carboxamide

Structural Information

Molecular Formula
C10H9FN4O
SMILES
C1=CC(=CC=C1N2C(=C(C=N2)C(=O)N)N)F
InChI
InChI=1S/C10H9FN4O/c11-6-1-3-7(4-2-6)15-9(12)8(5-14-15)10(13)16/h1-5H,12H2,(H2,13,16)
InChIKey
AXZGQTXCRLLNIN-UHFFFAOYSA-N
Compound name
5-amino-1-(4-fluorophenyl)pyrazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

220.07603 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.08331 145.4
[M+Na]+ 243.06525 155.7
[M+NH4]+ 238.10985 151.5
[M+K]+ 259.03919 153.1
[M-H]- 219.06875 146.7
[M+Na-2H]- 241.05070 151.4
[M]+ 220.07548 146.7
[M]- 220.07658 146.7
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

patents stripe