CID 80165359

2-[(5-amino-1h-1,3-benzodiazol-2-yl)(methyl)amino]-n-methylacetamide

Structural Information

Molecular Formula
C11H15N5O
SMILES
CNC(=O)CN(C)C1=NC2=C(N1)C=C(C=C2)N
InChI
InChI=1S/C11H15N5O/c1-13-10(17)6-16(2)11-14-8-4-3-7(12)5-9(8)15-11/h3-5H,6,12H2,1-2H3,(H,13,17)(H,14,15)
InChIKey
YREYLLLQLLXVKS-UHFFFAOYSA-N
Compound name
2-[(6-amino-1H-benzimidazol-2-yl)-methylamino]-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.12766 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.134936 150.7
[M+Na]+ 256.116878 158.6
[M-H]- 232.120384 153.2
[M+NH4]+ 251.161483 167.9
[M+K]+ 272.090818 155.8
[M+H-H2O]+ 216.124920 142.7
[M+HCOO]- 278.125861 175.1
[M+CH3COO]- 292.141511 198.9
[M+Na-2H]- 254.102326 156.3
[M]+ 233.12711142 150.5
[M]- 233.12820858 150.5
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.