2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide

C20H19FN2O2S — CID 16591781

IUPAC2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide
SMILESCCOc1ccccc1-c1nc(CC(=O)Nc2ccc(C)cc2F)cs1
InChIInChI=1S/C20H19FN2O2S/c1-3-25-18-7-5-4-6-15(18)20-22-14(12-26-20)11-19(24)23-17-9-8-13(2)10-16(17)21/h4-10,12H,3,11H2,1-2H3,(H,23,24)
InChIKeyWCONOGFRKHSLJD-UHFFFAOYSA-N
MW370.45 g/mol
LogP4.84
Rot. Bonds6

About 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide

2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide (PubChem CID 16591781) has the molecular formula C20H19FN2O2S and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide
PubChem CID16591781
Molecular FormulaC20H19FN2O2S
Molecular Weight370.45 g/mol
Exact Mass370.12
IUPAC Name2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide
SMILESCCOc1ccccc1-c1nc(CC(=O)Nc2ccc(C)cc2F)cs1
InChIInChI=1S/C20H19FN2O2S/c1-3-25-18-7-5-4-6-15(18)20-22-14(12-26-20)11-19(24)23-17-9-8-13(2)10-16(17)21/h4-10,12H,3,11H2,1-2H3,(H,23,24)
InChIKeyWCONOGFRKHSLJD-UHFFFAOYSA-N
XLogP4.84
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide?
The IUPAC name of 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide (CID 16591781) is 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide.
What is the SMILES notation for 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide?
The canonical SMILES for 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide is CCOc1ccccc1-c1nc(CC(=O)Nc2ccc(C)cc2F)cs1.
What is the InChIKey of 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide?
The InChIKey is WCONOGFRKHSLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2O2S/c1-3-25-18-7-5-4-6-15(18)20-22-14(12-26-20)11-19(24)23-17-9-8-13(2)10-16(17)21/h4-10,12H,3,11H2,1-2H3,(H,23,24).
What are the key properties of 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide?
2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide has a molecular weight of 370.45 g/mol, XLogP of 4.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(2-fluoro-4-methylphenyl)acetamide is sourced from PubChem (CID 16591781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).