CID 3079842

2,4-dichloro-n,n-diethyl-1,8-naphthyridine-3-carboxamide

Structural Information

Molecular Formula
C13H13Cl2N3O
SMILES
CCN(CC)C(=O)C1=C(N=C2C(=C1Cl)C=CC=N2)Cl
InChI
InChI=1S/C13H13Cl2N3O/c1-3-18(4-2)13(19)9-10(14)8-6-5-7-16-12(8)17-11(9)15/h5-7H,3-4H2,1-2H3
InChIKey
XKMALZUOFIFIJH-UHFFFAOYSA-N
Compound name
2,4-dichloro-N,N-diethyl-1,8-naphthyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

297.04358 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.05086 162.6
[M+Na]+ 320.03280 172.8
[M-H]- 296.03630 165.2
[M+NH4]+ 315.07740 178.4
[M+K]+ 336.00674 167.7
[M+H-H2O]+ 280.04084 155.5
[M+HCOO]- 342.04178 174.2
[M+CH3COO]- 356.05743 207.2
[M+Na-2H]- 318.01825 167.2
[M]+ 297.04303 168.6
[M]- 297.04413 168.6
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.