N-[2-(trifluoromethoxy)phenyl]acetamide

C9H8F3NO2 — CID 600772

IUPACN-[2-(trifluoromethoxy)phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OC(F)(F)F
InChIInChI=1S/C9H8F3NO2/c1-6(14)13-7-4-2-3-5-8(7)15-9(10,11)12/h2-5H,1H3,(H,13,14)
InChIKeyKZBHIVIJYKKLHL-UHFFFAOYSA-N
MW219.16 g/mol
LogP2.54
Rot. Bonds2

About N-[2-(trifluoromethoxy)phenyl]acetamide

N-[2-(trifluoromethoxy)phenyl]acetamide (PubChem CID 600772) has the molecular formula C9H8F3NO2 and a molecular weight of 219.16 g/mol. Its IUPAC name is N-[2-(trifluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-(trifluoromethoxy)phenyl]acetamide
PubChem CID600772
Molecular FormulaC9H8F3NO2
Molecular Weight219.16 g/mol
Exact Mass219.05
IUPAC NameN-[2-(trifluoromethoxy)phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OC(F)(F)F
InChIInChI=1S/C9H8F3NO2/c1-6(14)13-7-4-2-3-5-8(7)15-9(10,11)12/h2-5H,1H3,(H,13,14)
InChIKeyKZBHIVIJYKKLHL-UHFFFAOYSA-N
XLogP2.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.16
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(trifluoromethoxy)phenyl]acetamide?
The IUPAC name of N-[2-(trifluoromethoxy)phenyl]acetamide (CID 600772) is N-[2-(trifluoromethoxy)phenyl]acetamide.
What is the SMILES notation for N-[2-(trifluoromethoxy)phenyl]acetamide?
The canonical SMILES for N-[2-(trifluoromethoxy)phenyl]acetamide is CC(=O)Nc1ccccc1OC(F)(F)F.
What is the InChIKey of N-[2-(trifluoromethoxy)phenyl]acetamide?
The InChIKey is KZBHIVIJYKKLHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3NO2/c1-6(14)13-7-4-2-3-5-8(7)15-9(10,11)12/h2-5H,1H3,(H,13,14).
What are the key properties of N-[2-(trifluoromethoxy)phenyl]acetamide?
N-[2-(trifluoromethoxy)phenyl]acetamide has a molecular weight of 219.16 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(trifluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 600772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).