CID 3079847

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

Structural Information

Molecular Formula
C19H25ClN4O
SMILES
CCN(CC)C(=O)C1=C(N=C2C(=C1Cl)C=CC=N2)NC3CCCCC3
InChI
InChI=1S/C19H25ClN4O/c1-3-24(4-2)19(25)15-16(20)14-11-8-12-21-17(14)23-18(15)22-13-9-6-5-7-10-13/h8,11-13H,3-7,9-10H2,1-2H3,(H,21,22,23)
InChIKey
HMXOTLJNURDCRL-UHFFFAOYSA-N
Compound name
4-chloro-2-(cyclohexylamino)-N,N-diethyl-1,8-naphthyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.1717 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.17898 186.5
[M+Na]+ 383.16092 191.0
[M-H]- 359.16442 191.1
[M+NH4]+ 378.20552 198.0
[M+K]+ 399.13486 185.8
[M+H-H2O]+ 343.16896 176.3
[M+HCOO]- 405.16990 199.2
[M+CH3COO]- 419.18555 222.7
[M+Na-2H]- 381.14637 188.6
[M]+ 360.17115 186.1
[M]- 360.17225 186.1
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.