CID 6481353

N-cyclopentyl-4-[2-(cyclopentylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-7-amine

Structural Information

Molecular Formula
C27H29FN6
SMILES
C1CCC(C1)NC2=CC=C(C3=CC(=NN23)C4=CC=C(C=C4)F)C5=NC(=NC=C5)NC6CCCC6
InChI
InChI=1S/C27H29FN6/c28-19-11-9-18(10-12-19)24-17-25-22(13-14-26(34(25)33-24)30-20-5-1-2-6-20)23-15-16-29-27(32-23)31-21-7-3-4-8-21/h9-17,20-21,30H,1-8H2,(H,29,31,32)
InChIKey
WRWAXKZJSIOMRI-UHFFFAOYSA-N
Compound name
N-cyclopentyl-4-[2-(cyclopentylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

456.24377 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 457.25105 200.6
[M+Na]+ 479.23299 205.6
[M-H]- 455.23649 211.7
[M+NH4]+ 474.27759 208.6
[M+K]+ 495.20693 197.3
[M+H-H2O]+ 439.24103 187.3
[M+HCOO]- 501.24197 218.0
[M+CH3COO]- 515.25762 208.0
[M+Na-2H]- 477.21844 197.0
[M]+ 456.24322 196.0
[M]- 456.24432 196.0
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.