CID 1247123

N,4-dicyclohexyl-1-piperazinecarboxamide

Structural Information

Molecular Formula
C17H31N3O
SMILES
C1CCC(CC1)NC(=O)N2CCN(CC2)C3CCCCC3
InChI
InChI=1S/C17H31N3O/c21-17(18-15-7-3-1-4-8-15)20-13-11-19(12-14-20)16-9-5-2-6-10-16/h15-16H,1-14H2,(H,18,21)
InChIKey
LRAUBOSEUOPEDA-UHFFFAOYSA-N
Compound name
N,4-dicyclohexylpiperazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

4
Patents

293.2467 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.25398 175.2
[M+Na]+ 316.23592 172.4
[M-H]- 292.23942 178.3
[M+NH4]+ 311.28052 185.7
[M+K]+ 332.20986 169.1
[M+H-H2O]+ 276.24396 164.0
[M+HCOO]- 338.24490 184.4
[M+CH3COO]- 352.26055 202.5
[M+Na-2H]- 314.22137 173.3
[M]+ 293.24615 160.3
[M]- 293.24725 160.3
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