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

4
Patents

290.1089 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.116176 167.1
[M+Na]+ 313.098118 175.4
[M-H]- 289.101624 173.3
[M+NH4]+ 308.142723 183.9
[M+K]+ 329.072058 171.4
[M+H-H2O]+ 273.106160 159.6
[M+HCOO]- 335.107101 186.2
[M+CH3COO]- 349.122751 202.9
[M+Na-2H]- 311.083566 166.5
[M]+ 290.10835142 172.1
[M]- 290.10944858 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