2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide

C8H6F3NO2 — CID 13278497

IUPAC2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide
SMILESO=C(Nc1ccccc1O)C(F)(F)F
InChIInChI=1S/C8H6F3NO2/c9-8(10,11)7(14)12-5-3-1-2-4-6(5)13/h1-4,13H,(H,12,14)
InChIKeyJAMGJPVAHWWYJW-UHFFFAOYSA-N
MW205.13 g/mol
LogP1.89
Rot. Bonds1

About 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide

2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide (PubChem CID 13278497) has the molecular formula C8H6F3NO2 and a molecular weight of 205.13 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide
PubChem CID13278497
Molecular FormulaC8H6F3NO2
Molecular Weight205.13 g/mol
Exact Mass205.04
IUPAC Name2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide
SMILESO=C(Nc1ccccc1O)C(F)(F)F
InChIInChI=1S/C8H6F3NO2/c9-8(10,11)7(14)12-5-3-1-2-4-6(5)13/h1-4,13H,(H,12,14)
InChIKeyJAMGJPVAHWWYJW-UHFFFAOYSA-N
XLogP1.89
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.13
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide (CID 13278497) is 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide is O=C(Nc1ccccc1O)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide?
The InChIKey is JAMGJPVAHWWYJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F3NO2/c9-8(10,11)7(14)12-5-3-1-2-4-6(5)13/h1-4,13H,(H,12,14).
What are the key properties of 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide?
2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide has a molecular weight of 205.13 g/mol, XLogP of 1.89, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 13278497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).