CID 3058515

75348-41-3

Structural Information

Molecular Formula
C18H29N3O2
SMILES
CCN(CC)CCOC1=NC=C(C=C1)C(=O)NC2CCCCC2
InChI
InChI=1S/C18H29N3O2/c1-3-21(4-2)12-13-23-17-11-10-15(14-19-17)18(22)20-16-8-6-5-7-9-16/h10-11,14,16H,3-9,12-13H2,1-2H3,(H,20,22)
InChIKey
UWVQNQNHDCHERG-UHFFFAOYSA-N
Compound name
N-cyclohexyl-6-[2-(diethylamino)ethoxy]pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.22598 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.233256 179.1
[M+Na]+ 342.215198 180.0
[M-H]- 318.218704 183.7
[M+NH4]+ 337.259803 191.3
[M+K]+ 358.189138 178.0
[M+H-H2O]+ 302.223240 168.9
[M+HCOO]- 364.224181 198.6
[M+CH3COO]- 378.239831 215.6
[M+Na-2H]- 340.200646 180.3
[M]+ 319.22543142 177.4
[M]- 319.22652858 177.4
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.