CID 3043210

Brn 0685450

Structural Information

Molecular Formula
C20H25N5
SMILES
CCN(CC)CCNC1=NC2=C(C=CC(=N2)N)C(=C1)C3=CC=CC=C3
InChI
InChI=1S/C20H25N5/c1-3-25(4-2)13-12-22-19-14-17(15-8-6-5-7-9-15)16-10-11-18(21)23-20(16)24-19/h5-11,14H,3-4,12-13H2,1-2H3,(H3,21,22,23,24)
InChIKey
AYNZRKAUQDGEQS-UHFFFAOYSA-N
Compound name
2-N-[2-(diethylamino)ethyl]-4-phenyl-1,8-naphthyridine-2,7-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.211 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.21828 182.2
[M+Na]+ 358.20022 187.9
[M-H]- 334.20372 187.5
[M+NH4]+ 353.24482 193.6
[M+K]+ 374.17416 182.4
[M+H-H2O]+ 318.20826 171.1
[M+HCOO]- 380.20920 204.5
[M+CH3COO]- 394.22485 224.0
[M+Na-2H]- 356.18567 188.2
[M]+ 335.21045 182.4
[M]- 335.21155 182.4
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.