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-aminopyridin-3-yl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

377
Patents

277.17902 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.18630 168.4
[M+Na]+ 300.16824 173.1
[M-H]- 276.17174 171.3
[M+NH4]+ 295.21284 181.2
[M+K]+ 316.14218 170.4
[M+H-H2O]+ 260.17628 159.7
[M+HCOO]- 322.17722 184.0
[M+CH3COO]- 336.19287 200.6
[M+Na-2H]- 298.15369 170.7
[M]+ 277.17847 164.5
[M]- 277.17957 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