CID 155727917

2556762-71-9

Structural Information

Molecular Formula
C18H20F2N4O2
SMILES
CC1(CCC1NC(=O)C2=C(C=CC(=N2)NC3=CC(=NC(=C3)F)F)OC)C
InChI
InChI=1S/C18H20F2N4O2/c1-18(2)7-6-12(18)22-17(25)16-11(26-3)4-5-15(24-16)21-10-8-13(19)23-14(20)9-10/h4-5,8-9,12H,6-7H2,1-3H3,(H,22,25)(H,21,23,24)
InChIKey
MTNOCCGVGVKVCV-UHFFFAOYSA-N
Compound name
6-[(2,6-difluoropyridin-4-yl)amino]-N-(2,2-dimethylcyclobutyl)-3-methoxypyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

362.15543 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.16271 189.7
[M+Na]+ 385.14465 196.1
[M-H]- 361.14815 194.2
[M+NH4]+ 380.18925 194.6
[M+K]+ 401.11859 194.9
[M+H-H2O]+ 345.15269 172.3
[M+HCOO]- 407.15363 207.2
[M+CH3COO]- 421.16928 224.0
[M+Na-2H]- 383.13010 190.5
[M]+ 362.15488 196.8
[M]- 362.15598 196.8
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