CID 6410829

N-(6-(2-fluorophenyl)-4-methyl-3-pyridazinyl)-4-morpholineethanamine dihydrochloride

Structural Information

Molecular Formula
C17H21FN4O
SMILES
CC1=CC(=NN=C1NCCN2CCOCC2)C3=CC=CC=C3F
InChI
InChI=1S/C17H21FN4O/c1-13-12-16(14-4-2-3-5-15(14)18)20-21-17(13)19-6-7-22-8-10-23-11-9-22/h2-5,12H,6-11H2,1H3,(H,19,21)
InChIKey
JNWLEKZPDDGWRD-UHFFFAOYSA-N
Compound name
6-(2-fluorophenyl)-4-methyl-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

316.16995 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.17723 177.7
[M+Na]+ 339.15917 191.2
[M+NH4]+ 334.20377 184.2
[M+K]+ 355.13311 183.4
[M-H]- 315.16267 182.9
[M+Na-2H]- 337.14462 185.6
[M]+ 316.16940 181.0
[M]- 316.17050 181.0
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.