N-(3,3,3-trifluoropropyl)acetamide

C5H8F3NO — CID 59218642

IUPACN-(3,3,3-trifluoropropyl)acetamide
SMILESCC(=O)NCCC(F)(F)F
InChIInChI=1S/C5H8F3NO/c1-4(10)9-3-2-5(6,7)8/h2-3H2,1H3,(H,9,10)
InChIKeyREFOMOVIFMFRDJ-UHFFFAOYSA-N
MW155.12 g/mol
LogP1.07
Rot. Bonds2

About N-(3,3,3-trifluoropropyl)acetamide

N-(3,3,3-trifluoropropyl)acetamide (PubChem CID 59218642) has the molecular formula C5H8F3NO and a molecular weight of 155.12 g/mol. Its IUPAC name is N-(3,3,3-trifluoropropyl)acetamide.

Molecular Properties

Compound NameN-(3,3,3-trifluoropropyl)acetamide
PubChem CID59218642
Molecular FormulaC5H8F3NO
Molecular Weight155.12 g/mol
Exact Mass155.06
IUPAC NameN-(3,3,3-trifluoropropyl)acetamide
SMILESCC(=O)NCCC(F)(F)F
InChIInChI=1S/C5H8F3NO/c1-4(10)9-3-2-5(6,7)8/h2-3H2,1H3,(H,9,10)
InChIKeyREFOMOVIFMFRDJ-UHFFFAOYSA-N
XLogP1.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.12
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-Propylacetamide
CID 21407
N-Butylacetamide
CID 61265
N-Ethylpropionamide
CID 521324
2,2,2-Trifluoro-N-[4-(2,2,2-trifluoro-acetylamino)-butyl]-acetamide
CID 581000
2,2,2-Trifluoro-N-isopropylacetamide
CID 2305253
N-ethyl-2,2,3,3,4,4,4-heptafluorobutanamide
CID 4218327
N-Butyltrifluoroacetamide
CID 283366
n-Butyl-2,2,3,3,4,4,4-heptafluorobutanamide
CID 614617
2,2,3,3,4,4,4-Heptafluoro-n-propylbutanamide
CID 614782
N-Propylpropanamide
CID 347476
2,2,2-Trifluoro-n-propylacetamide
CID 580996
N-Ethyl-2,2,2-trifluoroacetamide
CID 581108

Frequently Asked Questions

What is the IUPAC name of N-(3,3,3-trifluoropropyl)acetamide?
The IUPAC name of N-(3,3,3-trifluoropropyl)acetamide (CID 59218642) is N-(3,3,3-trifluoropropyl)acetamide.
What is the SMILES notation for N-(3,3,3-trifluoropropyl)acetamide?
The canonical SMILES for N-(3,3,3-trifluoropropyl)acetamide is CC(=O)NCCC(F)(F)F.
What is the InChIKey of N-(3,3,3-trifluoropropyl)acetamide?
The InChIKey is REFOMOVIFMFRDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8F3NO/c1-4(10)9-3-2-5(6,7)8/h2-3H2,1H3,(H,9,10).
What are the key properties of N-(3,3,3-trifluoropropyl)acetamide?
N-(3,3,3-trifluoropropyl)acetamide has a molecular weight of 155.12 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3,3-trifluoropropyl)acetamide is sourced from PubChem (CID 59218642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).