CID 3079288

4h-pyrido(1,2-a)pyrimidine-3-carboxamide, n-(4-fluorophenyl)-6-methyl-4-oxo-

Structural Information

Molecular Formula
C16H12FN3O2
SMILES
CC1=CC=CC2=NC=C(C(=O)N12)C(=O)NC3=CC=C(C=C3)F
InChI
InChI=1S/C16H12FN3O2/c1-10-3-2-4-14-18-9-13(16(22)20(10)14)15(21)19-12-7-5-11(17)6-8-12/h2-9H,1H3,(H,19,21)
InChIKey
UEHBHFUOPPIXOA-UHFFFAOYSA-N
Compound name
N-(4-fluorophenyl)-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

297.09137 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.098646 166.3
[M+Na]+ 320.080588 176.5
[M-H]- 296.084094 170.7
[M+NH4]+ 315.125193 179.6
[M+K]+ 336.054528 170.9
[M+H-H2O]+ 280.088630 155.8
[M+HCOO]- 342.089571 186.7
[M+CH3COO]- 356.105221 177.7
[M+Na-2H]- 318.066036 172.3
[M]+ 297.09082142 166.4
[M]- 297.09191858 166.4
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