CID 96736

4-(cyclohexylamino)piperidine-4-carboxamide

Structural Information

Molecular Formula
C12H23N3O
SMILES
C1CCC(CC1)NC2(CCNCC2)C(=O)N
InChI
InChI=1S/C12H23N3O/c13-11(16)12(6-8-14-9-7-12)15-10-4-2-1-3-5-10/h10,14-15H,1-9H2,(H2,13,16)
InChIKey
IUPNXQPHGAGYNA-UHFFFAOYSA-N
Compound name
4-(cyclohexylamino)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

12
Patents

225.18411 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.191386 154.4
[M+Na]+ 248.173328 154.5
[M-H]- 224.176834 155.6
[M+NH4]+ 243.217933 170.4
[M+K]+ 264.147268 151.7
[M+H-H2O]+ 208.181370 146.7
[M+HCOO]- 270.182311 168.7
[M+CH3COO]- 284.197961 189.3
[M+Na-2H]- 246.158776 156.7
[M]+ 225.18356142 140.9
[M]- 225.18465858 140.9
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