CID 24801862

N-cyclohexyl-4-imidazo[1,2-a]pyridin-3-yl-n-methylpyrimidin-2-amine

Structural Information

Molecular Formula
C18H21N5
SMILES
CN(C1CCCCC1)C2=NC=CC(=N2)C3=CN=C4N3C=CC=C4
InChI
InChI=1S/C18H21N5/c1-22(14-7-3-2-4-8-14)18-19-11-10-15(21-18)16-13-20-17-9-5-6-12-23(16)17/h5-6,9-14H,2-4,7-8H2,1H3
InChIKey
HYNNWLVWJXWXFO-UHFFFAOYSA-N
Compound name
N-cyclohexyl-4-imidazo[1,2-a]pyridin-3-yl-N-methylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

12
Patents

307.1797 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.18698 172.2
[M+Na]+ 330.16892 178.6
[M-H]- 306.17242 178.2
[M+NH4]+ 325.21352 183.7
[M+K]+ 346.14286 173.0
[M+H-H2O]+ 290.17696 159.6
[M+HCOO]- 352.17790 190.1
[M+CH3COO]- 366.19355 181.8
[M+Na-2H]- 328.15437 176.8
[M]+ 307.17915 169.9
[M]- 307.18025 169.9
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