CID 49839963

Tert-butyl 4-(6-aminopyridin-3-yl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C15H23N3O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C2=CN=C(C=C2)N
InChI
InChI=1S/C15H23N3O2/c1-15(2,3)20-14(19)18-8-6-11(7-9-18)12-4-5-13(16)17-10-12/h4-5,10-11H,6-9H2,1-3H3,(H2,16,17)
InChIKey
UGJYTOMOCDGLRS-UHFFFAOYSA-N
Compound name
tert-butyl 4-(6-amino-3-pyridinyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

332
Patents

277.17902 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.186296 168.4
[M+Na]+ 300.168238 173.1
[M-H]- 276.171744 171.3
[M+NH4]+ 295.212843 181.2
[M+K]+ 316.142178 170.4
[M+H-H2O]+ 260.176280 159.7
[M+HCOO]- 322.177221 184.0
[M+CH3COO]- 336.192871 200.6
[M+Na-2H]- 298.153686 170.7
[M]+ 277.17847142 164.5
[M]- 277.17956858 164.5
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