CID 9821250

195055-03-9

Structural Information

Molecular Formula
C22H32N6
SMILES
CCCN(CCC)C1=CC(=NC2=C(C(=NN12)C)C3=CN=C(C=C3C)N(C)C)C
InChI
InChI=1S/C22H32N6/c1-8-10-27(11-9-2)20-13-16(4)24-22-21(17(5)25-28(20)22)18-14-23-19(26(6)7)12-15(18)3/h12-14H,8-11H2,1-7H3
InChIKey
ANNRUWYFVIGKHA-UHFFFAOYSA-N
Compound name
3-[6-(dimethylamino)-4-methylpyridin-3-yl]-2,5-dimethyl-N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

86
References

155
Patents

380.26886 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.27614 197.1
[M+Na]+ 403.25808 211.3
[M+NH4]+ 398.30268 203.5
[M+K]+ 419.23202 205.4
[M-H]- 379.26158 201.5
[M+Na-2H]- 401.24353 203.7
[M]+ 380.26831 200.5
[M]- 380.26941 200.5
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