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]+ 252.170656 161.6
[M+Na]+ 274.152598 165.7
[M-H]- 250.156104 165.9
[M+NH4]+ 269.197203 177.4
[M+K]+ 290.126538 165.7
[M+H-H2O]+ 234.160640 153.5
[M+HCOO]- 296.161581 180.0
[M+CH3COO]- 310.177231 196.5
[M+Na-2H]- 272.138046 160.0
[M]+ 251.16283142 160.5
[M]- 251.16392858 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.