CID 3076123

130260-02-5

Structural Information

Molecular Formula
C16H25N3O2
SMILES
CCN1CCCC(C1)NC(=O)C2=C(C=CC(=C2)NC)OC
InChI
InChI=1S/C16H25N3O2/c1-4-19-9-5-6-13(11-19)18-16(20)14-10-12(17-2)7-8-15(14)21-3/h7-8,10,13,17H,4-6,9,11H2,1-3H3,(H,18,20)
InChIKey
XWHNDBGCEUFEKS-UHFFFAOYSA-N
Compound name
N-(1-ethylpiperidin-3-yl)-2-methoxy-5-(methylamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.19467 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.20195 170.6
[M+Na]+ 314.18389 174.3
[M-H]- 290.18739 175.1
[M+NH4]+ 309.22849 184.1
[M+K]+ 330.15783 171.4
[M+H-H2O]+ 274.19193 161.6
[M+HCOO]- 336.19287 190.4
[M+CH3COO]- 350.20852 208.7
[M+Na-2H]- 312.16934 172.2
[M]+ 291.19412 167.9
[M]- 291.19522 167.9
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.