CID 22762711

N-(4-methylcyclohexyl)-2-(piperazin-1-yl)acetamide

Structural Information

Molecular Formula
C13H25N3O
SMILES
CC1CCC(CC1)NC(=O)CN2CCNCC2
InChI
InChI=1S/C13H25N3O/c1-11-2-4-12(5-3-11)15-13(17)10-16-8-6-14-7-9-16/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKey
CAAOEHIVBPMQOK-UHFFFAOYSA-N
Compound name
N-(4-methylcyclohexyl)-2-piperazin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

239.19977 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.20705 160.6
[M+Na]+ 262.18899 161.1
[M-H]- 238.19249 160.8
[M+NH4]+ 257.23359 173.6
[M+K]+ 278.16293 158.0
[M+H-H2O]+ 222.19703 151.5
[M+HCOO]- 284.19797 172.9
[M+CH3COO]- 298.21362 191.5
[M+Na-2H]- 260.17444 161.2
[M]+ 239.19922 149.6
[M]- 239.20032 149.6
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

patents stripe