CID 508485

Schembl7079215

Structural Information

Molecular Formula
C19H16N6O
SMILES
CC1=NC(=C(C=C1)C(=O)NC2=CN=CC=C2)NC3=CC4=C(C=C3)C=NN4
InChI
InChI=1S/C19H16N6O/c1-12-4-7-16(19(26)24-15-3-2-8-20-11-15)18(22-12)23-14-6-5-13-10-21-25-17(13)9-14/h2-11H,1H3,(H,21,25)(H,22,23)(H,24,26)
InChIKey
IKGGUYDFTAMBOL-UHFFFAOYSA-N
Compound name
2-(1H-indazol-6-ylamino)-6-methyl-N-pyridin-3-ylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

344.13855 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.14583 178.3
[M+Na]+ 367.12777 186.7
[M-H]- 343.13127 183.6
[M+NH4]+ 362.17237 187.2
[M+K]+ 383.10171 179.0
[M+H-H2O]+ 327.13581 166.9
[M+HCOO]- 389.13675 198.8
[M+CH3COO]- 403.15240 187.8
[M+Na-2H]- 365.11322 185.5
[M]+ 344.13800 177.7
[M]- 344.13910 177.7
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.