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]+ 240.207046 160.6
[M+Na]+ 262.188988 161.1
[M-H]- 238.192494 160.8
[M+NH4]+ 257.233593 173.6
[M+K]+ 278.162928 158.0
[M+H-H2O]+ 222.197030 151.5
[M+HCOO]- 284.197971 172.9
[M+CH3COO]- 298.213621 191.5
[M+Na-2H]- 260.174436 161.2
[M]+ 239.19922142 149.6
[M]- 239.20031858 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