CID 118753044

Deethyl dpa-714

Structural Information

Molecular Formula
C20H23FN4O2
SMILES
CCNC(=O)CC1=C2N=C(C=C(N2N=C1C3=CC=C(C=C3)OCCF)C)C
InChI
InChI=1S/C20H23FN4O2/c1-4-22-18(26)12-17-19(15-5-7-16(8-6-15)27-10-9-21)24-25-14(3)11-13(2)23-20(17)25/h5-8,11H,4,9-10,12H2,1-3H3,(H,22,26)
InChIKey
IGPHRGQVBIEWSO-UHFFFAOYSA-N
Compound name
N-ethyl-2-[2-[4-(2-fluoroethoxy)phenyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

370.1805 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.187776 190.1
[M+Na]+ 393.169718 199.8
[M-H]- 369.173224 193.3
[M+NH4]+ 388.214323 201.4
[M+K]+ 409.143658 193.7
[M+H-H2O]+ 353.177760 178.9
[M+HCOO]- 415.178701 209.8
[M+CH3COO]- 429.194351 222.1
[M+Na-2H]- 391.155166 191.4
[M]+ 370.17995142 195.3
[M]- 370.18104858 195.3
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.