CID 478041

4-chloro-3,7-dimethyl-2-(1-piperidinyl)[1,8]naphthyridine

Structural Information

Molecular Formula
C15H18ClN3
SMILES
CC1=NC2=C(C=C1)C(=C(C(=N2)N3CCCCC3)C)Cl
InChI
InChI=1S/C15H18ClN3/c1-10-6-7-12-13(16)11(2)15(18-14(12)17-10)19-8-4-3-5-9-19/h6-7H,3-5,8-9H2,1-2H3
InChIKey
FAVTWGFHIVCUTG-UHFFFAOYSA-N
Compound name
4-chloro-3,7-dimethyl-2-piperidin-1-yl-1,8-naphthyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

275.11893 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.12621 165.3
[M+Na]+ 298.10815 174.2
[M-H]- 274.11165 168.0
[M+NH4]+ 293.15275 179.4
[M+K]+ 314.08209 167.6
[M+H-H2O]+ 258.11619 155.4
[M+HCOO]- 320.11713 175.8
[M+CH3COO]- 334.13278 175.5
[M+Na-2H]- 296.09360 169.1
[M]+ 275.11838 164.0
[M]- 275.11948 164.0
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

No patent data available for this compound.