4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide

C11H9FN2O2S — CID 168988816

IUPAC4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide
SMILESCOc1cccc(F)c1-c1csc(C(N)=O)n1
InChIInChI=1S/C11H9FN2O2S/c1-16-8-4-2-3-6(12)9(8)7-5-17-11(14-7)10(13)15/h2-5H,1H3,(H2,13,15)
InChIKeyVJCAUEGMTNYBIJ-UHFFFAOYSA-N
MW252.27 g/mol
LogP2.06
Rot. Bonds3

About 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide

4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide (PubChem CID 168988816) has the molecular formula C11H9FN2O2S and a molecular weight of 252.27 g/mol. Its IUPAC name is 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide
PubChem CID168988816
Molecular FormulaC11H9FN2O2S
Molecular Weight252.27 g/mol
Exact Mass252.04
IUPAC Name4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide
SMILESCOc1cccc(F)c1-c1csc(C(N)=O)n1
InChIInChI=1S/C11H9FN2O2S/c1-16-8-4-2-3-6(12)9(8)7-5-17-11(14-7)10(13)15/h2-5H,1H3,(H2,13,15)
InChIKeyVJCAUEGMTNYBIJ-UHFFFAOYSA-N
XLogP2.06
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(2-fluoro-6-methoxyphenyl)-1,3-thiazol-2-yl]-2-methylpropanenitrile
CID 103097298
4-(2-chloro-3,4-dimethoxyphenyl)-1,3-thiazole-2-carboxamide
CID 19375983
4-(3,4-dimethylphenyl)-1,3-thiazole-2-carboxamide
CID 19375996
amino-[6-(2-fluoro-6-methoxyphenyl)-2-pyridinyl]methanol
CID 170082323
2-(2,6-difluorophenyl)-5-(2-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 68520217
2-(2-fluoro-6-methoxyphenyl)pyridine
CID 66942163
4-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1,3-thiazole-2-carboxamide
CID 173150144
2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide
CID 56713578
methyl 2-cyano-2-[4-(2,6-difluorophenyl)-1,3-thiazol-2-yl]acetate
CID 54303231
N-[4-(2,6-difluorophenyl)-1,3-thiazol-2-yl]acetamide
CID 39038759
4-(3-fluoro-4-methoxyphenyl)-1,3-thiazole-2-carbothioamide
CID 73253852
2-[2-(2-fluoro-6-methoxyphenyl)-4-methylphenoxy]acetamide
CID 56717628

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide?
The IUPAC name of 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide (CID 168988816) is 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide?
The canonical SMILES for 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide is COc1cccc(F)c1-c1csc(C(N)=O)n1.
What is the InChIKey of 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide?
The InChIKey is VJCAUEGMTNYBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O2S/c1-16-8-4-2-3-6(12)9(8)7-5-17-11(14-7)10(13)15/h2-5H,1H3,(H2,13,15).
What are the key properties of 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide?
4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide has a molecular weight of 252.27 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-6-methoxyphenyl)-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 168988816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).