CID 165719175

2742657-52-7

Structural Information

Molecular Formula
C19H25N5O2
SMILES
CC1CN2C(=CC(=N2)C(=O)NCC(C3=CC=C(C=C3)C(C)C)N)C(=O)N1
InChI
InChI=1S/C19H25N5O2/c1-11(2)13-4-6-14(7-5-13)15(20)9-21-18(25)16-8-17-19(26)22-12(3)10-24(17)23-16/h4-8,11-12,15H,9-10,20H2,1-3H3,(H,21,25)(H,22,26)
InChIKey
MENCXIXYWSXRQT-UHFFFAOYSA-N
Compound name
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-6-methyl-4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.20084 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.208116 187.2
[M+Na]+ 378.190058 191.8
[M-H]- 354.193564 189.1
[M+NH4]+ 373.234663 197.2
[M+K]+ 394.163998 186.9
[M+H-H2O]+ 338.198100 177.8
[M+HCOO]- 400.199041 201.4
[M+CH3COO]- 414.214691 220.0
[M+Na-2H]- 376.175506 184.9
[M]+ 355.20029142 183.4
[M]- 355.20138858 183.4
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

No patent data available for this compound.