CID 3042232

2,6-dimethyl-n-4-pyridinyl-n-(3-(trifluoromethyl)phenyl)-4-morpholinepropanamine

Structural Information

Molecular Formula
C21H26F3N3O
SMILES
CC1CN(CC(O1)C)CCCN(C2=CC=NC=C2)C3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C21H26F3N3O/c1-16-14-26(15-17(2)28-16)11-4-12-27(19-7-9-25-10-8-19)20-6-3-5-18(13-20)21(22,23)24/h3,5-10,13,16-17H,4,11-12,14-15H2,1-2H3
InChIKey
AXLFLMSKXLKSNK-UHFFFAOYSA-N
Compound name
N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-N-[3-(trifluoromethyl)phenyl]pyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

393.2028 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.21008 197.1
[M+Na]+ 416.19202 206.8
[M+NH4]+ 411.23662 201.5
[M+K]+ 432.16596 200.1
[M-H]- 392.19552 198.9
[M+Na-2H]- 414.17747 202.2
[M]+ 393.20225 198.8
[M]- 393.20335 198.8
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

No patent data available for this compound.