CID 157187

Droxicainide

Structural Information

Molecular Formula
C16H24N2O2
SMILES
CC1=C(C(=CC=C1)C)NC(=O)C2CCCCN2CCO
InChI
InChI=1S/C16H24N2O2/c1-12-6-5-7-13(2)15(12)17-16(20)14-8-3-4-9-18(14)10-11-19/h5-7,14,19H,3-4,8-11H2,1-2H3,(H,17,20)
InChIKey
NVASAXNGHUPVJX-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-1-(2-hydroxyethyl)piperidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

35
Patents

276.18378 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.191056 167.5
[M+Na]+ 299.172998 171.6
[M-H]- 275.176504 170.7
[M+NH4]+ 294.217603 181.3
[M+K]+ 315.146938 167.9
[M+H-H2O]+ 259.181040 159.2
[M+HCOO]- 321.181981 184.7
[M+CH3COO]- 335.197631 201.1
[M+Na-2H]- 297.158446 168.2
[M]+ 276.18323142 163.6
[M]- 276.18432858 163.6
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

patents stripe