CID 21850055

6-(2,6-dimethoxyphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine

Structural Information

Molecular Formula
C15H15N5O2
SMILES
COC1=C(C(=CC=C1)OC)C2=C(N=C3C(=C2)C=NC(=N3)N)N
InChI
InChI=1S/C15H15N5O2/c1-21-10-4-3-5-11(22-2)12(10)9-6-8-7-18-15(17)20-14(8)19-13(9)16/h3-7H,1-2H3,(H4,16,17,18,19,20)
InChIKey
LRPHIAJXODIASX-UHFFFAOYSA-N
Compound name
6-(2,6-dimethoxyphenyl)pyrido[2,3-d]pyrimidine-2,7-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

7
Patents

297.1226 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.12988 170.6
[M+Na]+ 320.11182 181.0
[M-H]- 296.11532 174.5
[M+NH4]+ 315.15642 182.2
[M+K]+ 336.08576 175.8
[M+H-H2O]+ 280.11986 160.4
[M+HCOO]- 342.12080 191.4
[M+CH3COO]- 356.13645 181.5
[M+Na-2H]- 318.09727 176.8
[M]+ 297.12205 171.8
[M]- 297.12315 171.8
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

patents stripe