CID 3068074

5-thiazolecarboxamide, 2-(2-methoxyphenyl)-4-methyl-n-propyl-

Structural Information

Molecular Formula
C15H18N2O2S
SMILES
CCCNC(=O)C1=C(N=C(S1)C2=CC=CC=C2OC)C
InChI
InChI=1S/C15H18N2O2S/c1-4-9-16-14(18)13-10(2)17-15(20-13)11-7-5-6-8-12(11)19-3/h5-8H,4,9H2,1-3H3,(H,16,18)
InChIKey
UKEXUOFKPZTJSJ-UHFFFAOYSA-N
Compound name
2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

290.1089 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.11618 167.1
[M+Na]+ 313.09812 175.4
[M-H]- 289.10162 173.3
[M+NH4]+ 308.14272 183.9
[M+K]+ 329.07206 171.4
[M+H-H2O]+ 273.10616 159.6
[M+HCOO]- 335.10710 186.2
[M+CH3COO]- 349.12275 202.9
[M+Na-2H]- 311.08357 166.5
[M]+ 290.10835 172.1
[M]- 290.10945 172.1
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