2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide

C16H12FN3O2S — CID 59152250

IUPAC2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(COc1ccc(-c2ccc(F)cc2)nc1)Nc1nccs1
InChIInChI=1S/C16H12FN3O2S/c17-12-3-1-11(2-4-12)14-6-5-13(9-19-14)22-10-15(21)20-16-18-7-8-23-16/h1-9H,10H2,(H,18,20,21)
InChIKeyWPEPONIMVRDQFS-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.36
Rot. Bonds5

About 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide

2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 59152250) has the molecular formula C16H12FN3O2S and a molecular weight of 329.36 g/mol. Its IUPAC name is 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide
PubChem CID59152250
Molecular FormulaC16H12FN3O2S
Molecular Weight329.36 g/mol
Exact Mass329.06
IUPAC Name2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(COc1ccc(-c2ccc(F)cc2)nc1)Nc1nccs1
InChIInChI=1S/C16H12FN3O2S/c17-12-3-1-11(2-4-12)14-6-5-13(9-19-14)22-10-15(21)20-16-18-7-8-23-16/h1-9H,10H2,(H,18,20,21)
InChIKeyWPEPONIMVRDQFS-UHFFFAOYSA-N
XLogP3.36
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide (CID 59152250) is 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide is O=C(COc1ccc(-c2ccc(F)cc2)nc1)Nc1nccs1.
What is the InChIKey of 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is WPEPONIMVRDQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN3O2S/c17-12-3-1-11(2-4-12)14-6-5-13(9-19-14)22-10-15(21)20-16-18-7-8-23-16/h1-9H,10H2,(H,18,20,21).
What are the key properties of 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide?
2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 329.36 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 59152250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).