CID 11682339

Schembl5119792

Structural Information

Molecular Formula
C21H26N6O
SMILES
CN(CC1=CN2C(=N1)C=CC=C2N3CCNCC3)C4CCOC5=C4N=CC=C5
InChI
InChI=1S/C21H26N6O/c1-25(17-7-13-28-18-4-3-8-23-21(17)18)14-16-15-27-19(24-16)5-2-6-20(27)26-11-9-22-10-12-26/h2-6,8,15,17,22H,7,9-14H2,1H3
InChIKey
KIYKAYZCIWGKNM-UHFFFAOYSA-N
Compound name
N-methyl-N-[(5-piperazin-1-ylimidazo[1,2-a]pyridin-2-yl)methyl]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

378.2168 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.22408 190.1
[M+Na]+ 401.20602 194.9
[M-H]- 377.20952 194.3
[M+NH4]+ 396.25062 196.0
[M+K]+ 417.17996 189.0
[M+H-H2O]+ 361.21406 176.5
[M+HCOO]- 423.21500 200.1
[M+CH3COO]- 437.23065 196.7
[M+Na-2H]- 399.19147 192.8
[M]+ 378.21625 185.7
[M]- 378.21735 185.7
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

patents stripe