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]+ 356.208116 189.7
[M+Na]+ 378.190058 194.4
[M-H]- 354.193564 195.0
[M+NH4]+ 373.234663 195.2
[M+K]+ 394.163998 191.3
[M+H-H2O]+ 338.198100 176.6
[M+HCOO]- 400.199041 203.9
[M+CH3COO]- 414.214691 220.2
[M+Na-2H]- 376.175506 191.5
[M]+ 355.20029142 189.1
[M]- 355.20138858 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.