CID 9574917

N-{4-[2-aza-2-(4-piperidylcarbonylamino)vinyl]cyclohexyl}acetamide

Structural Information

Molecular Formula
C15H26N4O2
SMILES
CC(=O)NC1CCC(CC1)/C=N\NC(=O)C2CCNCC2
InChI
InChI=1S/C15H26N4O2/c1-11(20)18-14-4-2-12(3-5-14)10-17-19-15(21)13-6-8-16-9-7-13/h10,12-14,16H,2-9H2,1H3,(H,18,20)(H,19,21)/b17-10-
InChIKey
NMDBPKBKEHVUQP-YVLHZVERSA-N
Compound name
N-[(Z)-(4-acetamidocyclohexyl)methylideneamino]piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

294.20557 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.21285 170.5
[M+Na]+ 317.19479 169.2
[M-H]- 293.19829 173.2
[M+NH4]+ 312.23939 182.5
[M+K]+ 333.16873 166.7
[M+H-H2O]+ 277.20283 161.3
[M+HCOO]- 339.20377 186.6
[M+CH3COO]- 353.21942 207.9
[M+Na-2H]- 315.18024 170.6
[M]+ 294.20502 159.5
[M]- 294.20612 159.5
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

No patent data available for this compound.