CID 3041464

Brn 0493668

Structural Information

Molecular Formula
C20H31N3O
SMILES
CC(CN1CCCCC1)N(C2=CC=CC=N2)C(=O)C3CCCCC3
InChI
InChI=1S/C20H31N3O/c1-17(16-22-14-8-3-9-15-22)23(19-12-6-7-13-21-19)20(24)18-10-4-2-5-11-18/h6-7,12-13,17-18H,2-5,8-11,14-16H2,1H3
InChIKey
JEKAXPLRSOYUKD-UHFFFAOYSA-N
Compound name
N-(1-piperidin-1-ylpropan-2-yl)-N-pyridin-2-ylcyclohexanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.2467 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.25398 182.3
[M+Na]+ 352.23592 180.2
[M-H]- 328.23942 187.2
[M+NH4]+ 347.28052 191.8
[M+K]+ 368.20986 177.3
[M+H-H2O]+ 312.24396 170.4
[M+HCOO]- 374.24490 194.5
[M+CH3COO]- 388.26055 213.8
[M+Na-2H]- 350.22137 181.1
[M]+ 329.24615 173.0
[M]- 329.24725 173.0
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

No patent data available for this compound.