CID 68731692

1446194-56-4

Structural Information

Molecular Formula
C19H24N4O2
SMILES
CC(C)CCNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2
InChI
InChI=1S/C19H24N4O2/c1-14(2)8-9-22-18(24)16(12-15-6-4-3-5-7-15)23-19(25)17-13-20-10-11-21-17/h3-7,10-11,13-14,16H,8-9,12H2,1-2H3,(H,22,24)(H,23,25)/t16-/m0/s1
InChIKey
UJZOAWFAGJVEGQ-INIZCTEOSA-N
Compound name
N-[(2S)-1-(3-methylbutylamino)-1-oxo-3-phenylpropan-2-yl]pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

91
Patents

340.1899 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.19718 182.6
[M+Na]+ 363.17912 192.1
[M+NH4]+ 358.22372 187.4
[M+K]+ 379.15306 186.8
[M-H]- 339.18262 184.9
[M+Na-2H]- 361.16457 189.0
[M]+ 340.18935 184.2
[M]- 340.19045 184.2
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