CID 6484152

3-(pyridin-2-yl)-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C8H8N4
SMILES
C1=CC=NC(=C1)C2=CC(=NN2)N
InChI
InChI=1S/C8H8N4/c9-8-5-7(11-12-8)6-3-1-2-4-10-6/h1-5H,(H3,9,11,12)
InChIKey
RJFHMLHZCNZQMA-UHFFFAOYSA-N
Compound name
5-pyridin-2-yl-1H-pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

137
Patents

160.07489 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.082166 131.4
[M+Na]+ 183.064108 140.3
[M-H]- 159.067614 132.9
[M+NH4]+ 178.108713 148.6
[M+K]+ 199.038048 136.2
[M+H-H2O]+ 143.072150 122.9
[M+HCOO]- 205.073091 153.6
[M+CH3COO]- 219.088741 144.2
[M+Na-2H]- 181.049556 138.4
[M]+ 160.07434142 127.6
[M]- 160.07543858 127.6
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

patents stripe