CID 121327414

Lti-291

Structural Information

Molecular Formula
C20H30N4O2
SMILES
CCCCCOC1CCC(CC1)NC(=O)C2=C3N=C(C=C(N3N=C2)C)C
InChI
InChI=1S/C20H30N4O2/c1-4-5-6-11-26-17-9-7-16(8-10-17)23-20(25)18-13-21-24-15(3)12-14(2)22-19(18)24/h12-13,16-17H,4-11H2,1-3H3,(H,23,25)
InChIKey
HZILSILAELSWKN-UHFFFAOYSA-N
Compound name
5,7-dimethyl-N-(4-pentoxycyclohexyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

358.23688 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.24416 189.8
[M+Na]+ 381.22610 195.5
[M-H]- 357.22960 192.8
[M+NH4]+ 376.27070 201.1
[M+K]+ 397.20004 190.6
[M+H-H2O]+ 341.23414 179.3
[M+HCOO]- 403.23508 206.3
[M+CH3COO]- 417.25073 219.3
[M+Na-2H]- 379.21155 189.5
[M]+ 358.23633 191.4
[M]- 358.23743 191.4
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