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]+ 292.201946 170.6
[M+Na]+ 314.183888 174.3
[M-H]- 290.187394 175.1
[M+NH4]+ 309.228493 184.1
[M+K]+ 330.157828 171.4
[M+H-H2O]+ 274.191930 161.6
[M+HCOO]- 336.192871 190.4
[M+CH3COO]- 350.208521 208.7
[M+Na-2H]- 312.169336 172.2
[M]+ 291.19412142 167.9
[M]- 291.19521858 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.