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
1
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]+ 226.19139 154.4
[M+Na]+ 248.17333 154.5
[M-H]- 224.17683 155.6
[M+NH4]+ 243.21793 170.4
[M+K]+ 264.14727 151.7
[M+H-H2O]+ 208.18137 146.7
[M+HCOO]- 270.18231 168.7
[M+CH3COO]- 284.19796 189.3
[M+Na-2H]- 246.15878 156.7
[M]+ 225.18356 140.9
[M]- 225.18466 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