CID 3047786

Necopidem

Structural Information

Molecular Formula
C23H29N3O
SMILES
CCC1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CN(C)C(=O)CC(C)C
InChI
InChI=1S/C23H29N3O/c1-6-18-8-10-19(11-9-18)23-20(15-25(5)22(27)13-16(2)3)26-14-17(4)7-12-21(26)24-23/h7-12,14,16H,6,13,15H2,1-5H3
InChIKey
YRMLUAGKHYADKJ-UHFFFAOYSA-N
Compound name
N-[[2-(4-ethylphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methyl]-N,3-dimethylbutanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

302
Patents

363.23105 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.238326 192.9
[M+Na]+ 386.220268 200.3
[M-H]- 362.223774 199.6
[M+NH4]+ 381.264873 206.3
[M+K]+ 402.194208 195.6
[M+H-H2O]+ 346.228310 183.0
[M+HCOO]- 408.229251 213.4
[M+CH3COO]- 422.244901 226.4
[M+Na-2H]- 384.205716 192.0
[M]+ 363.23050142 198.6
[M]- 363.23159858 198.6
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

patents stripe