CID 478036

Chembl2263588

Structural Information

Molecular Formula
C13H15ClN4
SMILES
C1CCN(CC1)C2=NC3=C(C=CC(=N3)N)C(=C2)Cl
InChI
InChI=1S/C13H15ClN4/c14-10-8-12(18-6-2-1-3-7-18)17-13-9(10)4-5-11(15)16-13/h4-5,8H,1-3,6-7H2,(H2,15,16,17)
InChIKey
ODQLVHZMEZNAIP-UHFFFAOYSA-N
Compound name
5-chloro-7-piperidin-1-yl-1,8-naphthyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

262.0985 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.10578 159.8
[M+Na]+ 285.08772 167.9
[M-H]- 261.09122 162.0
[M+NH4]+ 280.13232 173.6
[M+K]+ 301.06166 161.4
[M+H-H2O]+ 245.09576 150.1
[M+HCOO]- 307.09670 171.5
[M+CH3COO]- 321.11235 169.8
[M+Na-2H]- 283.07317 165.2
[M]+ 262.09795 156.0
[M]- 262.09905 156.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.