2-[3-(trifluoromethyl)phenoxy]acetamide

C9H8F3NO2 — CID 18954833

IUPAC2-[3-(trifluoromethyl)phenoxy]acetamide
SMILESNC(=O)COc1cccc(C(F)(F)F)c1
InChIInChI=1S/C9H8F3NO2/c10-9(11,12)6-2-1-3-7(4-6)15-5-8(13)14/h1-4H,5H2,(H2,13,14)
InChIKeyWJVYTGUVWZCFBX-UHFFFAOYSA-N
MW219.16 g/mol
LogP1.57
Rot. Bonds3

About 2-[3-(trifluoromethyl)phenoxy]acetamide

2-[3-(trifluoromethyl)phenoxy]acetamide (PubChem CID 18954833) has the molecular formula C9H8F3NO2 and a molecular weight of 219.16 g/mol. Its IUPAC name is 2-[3-(trifluoromethyl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[3-(trifluoromethyl)phenoxy]acetamide
PubChem CID18954833
Molecular FormulaC9H8F3NO2
Molecular Weight219.16 g/mol
Exact Mass219.05
IUPAC Name2-[3-(trifluoromethyl)phenoxy]acetamide
SMILESNC(=O)COc1cccc(C(F)(F)F)c1
InChIInChI=1S/C9H8F3NO2/c10-9(11,12)6-2-1-3-7(4-6)15-5-8(13)14/h1-4H,5H2,(H2,13,14)
InChIKeyWJVYTGUVWZCFBX-UHFFFAOYSA-N
XLogP1.57
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.16
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[3-(trifluoromethyl)phenoxy]propanamide
CID 55207241
1-[3-(trifluoromethyl)phenoxy]propan-2-one
CID 14574936
1-bromo-3-[3-(trifluoromethyl)phenoxy]propan-2-one
CID 87404421
[3-(trifluoromethyl)phenyl] carbamate
CID 56614861
3-[[2-[3-(trifluoromethyl)phenoxy]acetyl]amino]benzamide
CID 18084407
2-[3-amino-5-(trifluoromethyl)phenoxy]acetamide
CID 21049544
1-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]ethanone
CID 1471533
2-[3-(trifluoromethyl)phenoxy]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 100757803
3-(2-amino-2-oxoethoxy)benzoic acid
CID 961591
[[1-chloro-3-[3-(trifluoromethyl)phenoxy]propan-2-ylidene]amino]urea
CID 91567741
N-benzhydryl-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 100758154
1-(1-methylpyrrol-3-yl)-2-[3-(trifluoromethyl)phenoxy]ethanone
CID 60624588

Frequently Asked Questions

What is the IUPAC name of 2-[3-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of 2-[3-(trifluoromethyl)phenoxy]acetamide (CID 18954833) is 2-[3-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for 2-[3-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for 2-[3-(trifluoromethyl)phenoxy]acetamide is NC(=O)COc1cccc(C(F)(F)F)c1.
What is the InChIKey of 2-[3-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is WJVYTGUVWZCFBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3NO2/c10-9(11,12)6-2-1-3-7(4-6)15-5-8(13)14/h1-4H,5H2,(H2,13,14).
What are the key properties of 2-[3-(trifluoromethyl)phenoxy]acetamide?
2-[3-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 219.16 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 18954833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).