CID 71873201

N-{[5-(propan-2-yl)-1,3-oxazol-2-yl]methyl}-n-(pyrrolidin-3-yl)acetamide

Structural Information

Molecular Formula
C13H21N3O2
SMILES
CC(C)C1=CN=C(O1)CN(C2CCNC2)C(=O)C
InChI
InChI=1S/C13H21N3O2/c1-9(2)12-7-15-13(18-12)8-16(10(3)17)11-4-5-14-6-11/h7,9,11,14H,4-6,8H2,1-3H3
InChIKey
BBPCZOMOPFDMKH-UHFFFAOYSA-N
Compound name
N-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.16338 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.17066 161.6
[M+Na]+ 274.15260 165.7
[M-H]- 250.15610 165.9
[M+NH4]+ 269.19720 177.4
[M+K]+ 290.12654 165.7
[M+H-H2O]+ 234.16064 153.5
[M+HCOO]- 296.16158 180.0
[M+CH3COO]- 310.17723 196.5
[M+Na-2H]- 272.13805 160.0
[M]+ 251.16283 160.5
[M]- 251.16393 160.5
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.