CID 3079279

N-hexyl-6-methyl-4-oxo-4h-pyrido(1,2-a)pyrimidine-3-carboxamide

Structural Information

Molecular Formula
C16H21N3O2
SMILES
CCCCCCNC(=O)C1=CN=C2C=CC=C(N2C1=O)C
InChI
InChI=1S/C16H21N3O2/c1-3-4-5-6-10-17-15(20)13-11-18-14-9-7-8-12(2)19(14)16(13)21/h7-9,11H,3-6,10H2,1-2H3,(H,17,20)
InChIKey
WQSDPVQRXJGUTP-UHFFFAOYSA-N
Compound name
N-hexyl-6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

287.1634 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.170676 168.5
[M+Na]+ 310.152618 176.4
[M-H]- 286.156124 170.2
[M+NH4]+ 305.197223 182.6
[M+K]+ 326.126558 172.0
[M+H-H2O]+ 270.160660 159.7
[M+HCOO]- 332.161601 188.7
[M+CH3COO]- 346.177251 206.3
[M+Na-2H]- 308.138066 173.3
[M]+ 287.16285142 171.8
[M]- 287.16394858 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

No literature data available for this compound.

Patent stripe

patents stripe