CID 3080155

Benzamide, n,4-dimethyl-n-(4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)-, monohydrochloride

Structural Information

Molecular Formula
C19H25N5O2
SMILES
CCCC1=NC(=NC(=N1)N(C)C(=O)C2=CC=C(C=C2)C)N3CCOCC3
InChI
InChI=1S/C19H25N5O2/c1-4-5-16-20-18(22-19(21-16)24-10-12-26-13-11-24)23(3)17(25)15-8-6-14(2)7-9-15/h6-9H,4-5,10-13H2,1-3H3
InChIKey
DCQCUFUYFMMJOJ-UHFFFAOYSA-N
Compound name
N,4-dimethyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.20084 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.20812 189.7
[M+Na]+ 378.19006 194.4
[M-H]- 354.19356 195.0
[M+NH4]+ 373.23466 195.2
[M+K]+ 394.16400 191.3
[M+H-H2O]+ 338.19810 176.6
[M+HCOO]- 400.19904 203.9
[M+CH3COO]- 414.21469 220.2
[M+Na-2H]- 376.17551 191.5
[M]+ 355.20029 189.1
[M]- 355.20139 189.1
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.