CID 341869

N,n'-(4-methyl-1,3-phenylene)bis(1-piperidinecarboxamide)

Structural Information

Molecular Formula
C19H28N4O2
SMILES
CC1=C(C=C(C=C1)NC(=O)N2CCCCC2)NC(=O)N3CCCCC3
InChI
InChI=1S/C19H28N4O2/c1-15-8-9-16(20-18(24)22-10-4-2-5-11-22)14-17(15)21-19(25)23-12-6-3-7-13-23/h8-9,14H,2-7,10-13H2,1H3,(H,20,24)(H,21,25)
InChIKey
PPWYBOCLKAIBDX-UHFFFAOYSA-N
Compound name
N-[4-methyl-3-(piperidine-1-carbonylamino)phenyl]piperidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

2
Patents

344.22122 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.228496 184.3
[M+Na]+ 367.210438 184.0
[M-H]- 343.213944 189.0
[M+NH4]+ 362.255043 193.0
[M+K]+ 383.184378 180.3
[M+H-H2O]+ 327.218480 173.1
[M+HCOO]- 389.219421 197.9
[M+CH3COO]- 403.235071 214.6
[M+Na-2H]- 365.195886 183.8
[M]+ 344.22067142 174.3
[M]- 344.22176858 174.3
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