CID 12403616

2-(pyridin-2-yl)pyrimidin-4-amine

Structural Information

Molecular Formula
C9H8N4
SMILES
C1=CC=NC(=C1)C2=NC=CC(=N2)N
InChI
InChI=1S/C9H8N4/c10-8-4-6-12-9(13-8)7-3-1-2-5-11-7/h1-6H,(H2,10,12,13)
InChIKey
CRLLPKLYUMUJHY-UHFFFAOYSA-N
Compound name
2-pyridin-2-ylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

93
Patents

172.07489 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.082166 135.4
[M+Na]+ 195.064108 144.5
[M-H]- 171.067614 137.9
[M+NH4]+ 190.108713 150.9
[M+K]+ 211.038048 140.4
[M+H-H2O]+ 155.072150 126.2
[M+HCOO]- 217.073091 157.8
[M+CH3COO]- 231.088741 148.1
[M+Na-2H]- 193.049556 145.2
[M]+ 172.07434142 132.9
[M]- 172.07543858 132.9
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