CID 3151363

2-imino-n-(3-methoxypropyl)-5-oxo-1-propyl-1,5-dihydro-2h-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

Structural Information

Molecular Formula
C19H23N5O3
SMILES
CCCN1C2=C(C=C(C1=N)C(=O)NCCCOC)C(=O)N3C=CC=CC3=N2
InChI
InChI=1S/C19H23N5O3/c1-3-9-24-16(20)13(18(25)21-8-6-11-27-2)12-14-17(24)22-15-7-4-5-10-23(15)19(14)26/h4-5,7,10,12,20H,3,6,8-9,11H2,1-2H3,(H,21,25)
InChIKey
GTLSICMMQIZKLZ-UHFFFAOYSA-N
Compound name
6-imino-N-(3-methoxypropyl)-2-oxo-7-propyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

369.18008 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.187356 188.5
[M+Na]+ 392.169298 198.1
[M-H]- 368.172804 190.5
[M+NH4]+ 387.213903 198.6
[M+K]+ 408.143238 192.2
[M+H-H2O]+ 352.177340 178.0
[M+HCOO]- 414.178281 208.5
[M+CH3COO]- 428.193931 224.9
[M+Na-2H]- 390.154746 195.2
[M]+ 369.17953142 194.1
[M]- 369.18062858 194.1
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.