CID 3074383

1,8-naphthyridine-3-carboxamide, 4-chloro-n,n-diethyl-2-((2-methylpropyl)amino)-

Structural Information

Molecular Formula
C17H23ClN4O
SMILES
CCN(CC)C(=O)C1=C(N=C2C(=C1Cl)C=CC=N2)NCC(C)C
InChI
InChI=1S/C17H23ClN4O/c1-5-22(6-2)17(23)13-14(18)12-8-7-9-19-15(12)21-16(13)20-10-11(3)4/h7-9,11H,5-6,10H2,1-4H3,(H,19,20,21)
InChIKey
UCOVYGNIMSRXNQ-UHFFFAOYSA-N
Compound name
4-chloro-N,N-diethyl-2-(2-methylpropylamino)-1,8-naphthyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.15604 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.16332 180.5
[M+Na]+ 357.14526 187.6
[M-H]- 333.14876 183.3
[M+NH4]+ 352.18986 194.0
[M+K]+ 373.11920 183.2
[M+H-H2O]+ 317.15330 172.0
[M+HCOO]- 379.15424 196.0
[M+CH3COO]- 393.16989 220.7
[M+Na-2H]- 355.13071 183.0
[M]+ 334.15549 185.7
[M]- 334.15659 185.7
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.