N-(2,2,2-trifluoroethyl)acetamide

C4H6F3NO — CID 23168969

IUPACN-(2,2,2-trifluoroethyl)acetamide
SMILESCC(=O)NCC(F)(F)F
InChIInChI=1S/C4H6F3NO/c1-3(9)8-2-4(5,6)7/h2H2,1H3,(H,8,9)
InChIKeyGGFKQOQFSGPWBG-UHFFFAOYSA-N
MW141.09 g/mol
LogP0.68
Rot. Bonds1

About N-(2,2,2-trifluoroethyl)acetamide

N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 23168969) has the molecular formula C4H6F3NO and a molecular weight of 141.09 g/mol. Its IUPAC name is N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound NameN-(2,2,2-trifluoroethyl)acetamide
PubChem CID23168969
Molecular FormulaC4H6F3NO
Molecular Weight141.09 g/mol
Exact Mass141.04
IUPAC NameN-(2,2,2-trifluoroethyl)acetamide
SMILESCC(=O)NCC(F)(F)F
InChIInChI=1S/C4H6F3NO/c1-3(9)8-2-4(5,6)7/h2H2,1H3,(H,8,9)
InChIKeyGGFKQOQFSGPWBG-UHFFFAOYSA-N
XLogP0.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.09
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2,2,2-trifluoroethylamino)ethyl]acetamide
CID 43401592
N-(2,2-difluorobutyl)acetamide
CID 88583149
2,3-dimethyl-4-oxo-4-(2,2,2-trifluoroethylamino)but-2-enoic acid
CID 76991747
(Z)-3-sulfanyl-4-(2,2,2-trifluoroethylamino)pent-3-en-2-one
CID 89320251
2,2,2-trifluoroethylcarbamoyl N-(2,2,2-trifluoroethyl)carbamate
CID 175955697
N-(2-methyl-2-sulfanylpropyl)acetamide
CID 10374590
2-amino-N-(2,2,2-trifluoroethyl)propanamide
CID 24690825
2-(4-acetamidophenyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 9263287
N-[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]propyl]acetamide
CID 155398854
[1-oxo-1-(2,2,2-trifluoroethylamino)butan-2-yl]azanium chloride
CID 90216700
N-(fluoromethyl)acetamide
CID 90974509
N'-(2,2,2-trifluoroethyl)propanediamide
CID 87594985

Frequently Asked Questions

What is the IUPAC name of N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of N-(2,2,2-trifluoroethyl)acetamide (CID 23168969) is N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for N-(2,2,2-trifluoroethyl)acetamide is CC(=O)NCC(F)(F)F.
What is the InChIKey of N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is GGFKQOQFSGPWBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F3NO/c1-3(9)8-2-4(5,6)7/h2H2,1H3,(H,8,9).
What are the key properties of N-(2,2,2-trifluoroethyl)acetamide?
N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 141.09 g/mol, XLogP of 0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 23168969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).