CID 454390

143707-86-2

Structural Information

Molecular Formula
C15H16N4O2
SMILES
CCC1=C(NC(=O)C(=C1)NCC2=NC3=C(O2)C=CC=N3)C
InChI
InChI=1S/C15H16N4O2/c1-3-10-7-11(15(20)18-9(10)2)17-8-13-19-14-12(21-13)5-4-6-16-14/h4-7,17H,3,8H2,1-2H3,(H,18,20)
InChIKey
FUUHEGQXWZMINO-UHFFFAOYSA-N
Compound name
5-ethyl-6-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-ylmethylamino)-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

284.12732 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.13460 165.5
[M+Na]+ 307.11654 176.7
[M-H]- 283.12004 169.9
[M+NH4]+ 302.16114 178.3
[M+K]+ 323.09048 171.7
[M+H-H2O]+ 267.12458 156.4
[M+HCOO]- 329.12552 186.7
[M+CH3COO]- 343.14117 177.4
[M+Na-2H]- 305.10199 171.8
[M]+ 284.12677 169.3
[M]- 284.12787 169.3
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

No patent data available for this compound.