2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide

C11H9FN2OS — CID 66761457

IUPAC2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide
SMILESNC(=O)C(F)(c1ccccc1)c1nccs1
InChIInChI=1S/C11H9FN2OS/c12-11(9(13)15,10-14-6-7-16-10)8-4-2-1-3-5-8/h1-7H,(H2,13,15)
InChIKeyKBSSIRCUDGJNHQ-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.84
Rot. Bonds3

About 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide

2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide (PubChem CID 66761457) has the molecular formula C11H9FN2OS and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide
PubChem CID66761457
Molecular FormulaC11H9FN2OS
Molecular Weight236.27 g/mol
Exact Mass236.04
IUPAC Name2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide
SMILESNC(=O)C(F)(c1ccccc1)c1nccs1
InChIInChI=1S/C11H9FN2OS/c12-11(9(13)15,10-14-6-7-16-10)8-4-2-1-3-5-8/h1-7H,(H2,13,15)
InChIKeyKBSSIRCUDGJNHQ-UHFFFAOYSA-N
XLogP1.84
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide (CID 66761457) is 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide is NC(=O)C(F)(c1ccccc1)c1nccs1.
What is the InChIKey of 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide?
The InChIKey is KBSSIRCUDGJNHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2OS/c12-11(9(13)15,10-14-6-7-16-10)8-4-2-1-3-5-8/h1-7H,(H2,13,15).
What are the key properties of 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide?
2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide has a molecular weight of 236.27 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-phenyl-2-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 66761457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).