CID 16071896

925676-48-8

Structural Information

Molecular Formula
C18H14FN5O
SMILES
C1CC1C(=O)NC2=CN=C(C(=N2)C3=CN=CC=C3)C4=C(C=NC=C4)F
InChI
InChI=1S/C18H14FN5O/c19-14-9-21-7-5-13(14)17-16(12-2-1-6-20-8-12)23-15(10-22-17)24-18(25)11-3-4-11/h1-2,5-11H,3-4H2,(H,23,24,25)
InChIKey
XUYURJQIMYCWBB-UHFFFAOYSA-N
Compound name
N-[5-(3-fluoro-4-pyridinyl)-6-pyridin-3-ylpyrazin-2-yl]cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

18
Patents

335.11823 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.12551 185.3
[M+Na]+ 358.10745 195.1
[M-H]- 334.11095 191.7
[M+NH4]+ 353.15205 188.0
[M+K]+ 374.08139 186.8
[M+H-H2O]+ 318.11549 172.4
[M+HCOO]- 380.11643 204.4
[M+CH3COO]- 394.13208 193.8
[M+Na-2H]- 356.09290 189.9
[M]+ 335.11768 185.0
[M]- 335.11878 185.0
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

No patent data available for this compound.