CID 66545141

1-cyclopentyl-1h,2h,3h-imidazo[4,5-b]pyridin-2-one

Structural Information

Molecular Formula
C11H13N3O
SMILES
C1CCC(C1)N2C3=C(NC2=O)N=CC=C3
InChI
InChI=1S/C11H13N3O/c15-11-13-10-9(6-3-7-12-10)14(11)8-4-1-2-5-8/h3,6-8H,1-2,4-5H2,(H,12,13,15)
InChIKey
WPEWVIVXCJELQE-UHFFFAOYSA-N
Compound name
1-cyclopentyl-3H-imidazo[4,5-b]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

203.10587 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.113146 142.7
[M+Na]+ 226.095088 152.5
[M-H]- 202.098594 145.8
[M+NH4]+ 221.139693 161.7
[M+K]+ 242.069028 148.1
[M+H-H2O]+ 186.103130 134.7
[M+HCOO]- 248.104071 163.1
[M+CH3COO]- 262.119721 155.5
[M+Na-2H]- 224.080536 146.6
[M]+ 203.10532142 141.1
[M]- 203.10641858 141.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.