CID 9925908

2-(1-propylpiperidin-4-yl)-1h-benzimidazole-4-carboxamide

Structural Information

Molecular Formula
C16H22N4O
SMILES
CCCN1CCC(CC1)C2=NC3=C(C=CC=C3N2)C(=O)N
InChI
InChI=1S/C16H22N4O/c1-2-8-20-9-6-11(7-10-20)16-18-13-5-3-4-12(15(17)21)14(13)19-16/h3-5,11H,2,6-10H2,1H3,(H2,17,21)(H,18,19)
InChIKey
KXSIHXHEHABEJX-UHFFFAOYSA-N
Compound name
2-(1-propylpiperidin-4-yl)-1H-benzimidazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

166
Patents

286.17935 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.18663 169.0
[M+Na]+ 309.16857 175.4
[M-H]- 285.17207 170.5
[M+NH4]+ 304.21317 182.1
[M+K]+ 325.14251 169.5
[M+H-H2O]+ 269.17661 159.6
[M+HCOO]- 331.17755 184.7
[M+CH3COO]- 345.19320 178.2
[M+Na-2H]- 307.15402 170.0
[M]+ 286.17880 164.8
[M]- 286.17990 164.8
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

No patent data available for this compound.