2-ethoxy-2,3,3,3-tetrafluoropropanamide

C5H7F4NO2 — CID 2802176

IUPAC2-ethoxy-2,3,3,3-tetrafluoropropanamide
SMILESCCOC(F)(C(N)=O)C(F)(F)F
InChIInChI=1S/C5H7F4NO2/c1-2-12-4(6,3(10)11)5(7,8)9/h2H2,1H3,(H2,10,11)
InChIKeyLPKUKZHFTQYNDK-UHFFFAOYSA-N
MW189.11 g/mol
LogP0.74
Rot. Bonds3

About 2-ethoxy-2,3,3,3-tetrafluoropropanamide

2-ethoxy-2,3,3,3-tetrafluoropropanamide (PubChem CID 2802176) has the molecular formula C5H7F4NO2 and a molecular weight of 189.11 g/mol. Its IUPAC name is 2-ethoxy-2,3,3,3-tetrafluoropropanamide.

Molecular Properties

Compound Name2-ethoxy-2,3,3,3-tetrafluoropropanamide
PubChem CID2802176
Molecular FormulaC5H7F4NO2
Molecular Weight189.11 g/mol
Exact Mass189.04
IUPAC Name2-ethoxy-2,3,3,3-tetrafluoropropanamide
SMILESCCOC(F)(C(N)=O)C(F)(F)F
InChIInChI=1S/C5H7F4NO2/c1-2-12-4(6,3(10)11)5(7,8)9/h2H2,1H3,(H2,10,11)
InChIKeyLPKUKZHFTQYNDK-UHFFFAOYSA-N
XLogP0.74
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.11
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-2-hydroxypropanediamide
CID 45122517
2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-amine
CID 165349343
ethyl 3-amino-3-ethoxy-2-(trifluoromethyl)prop-2-enoate
CID 150072714
2,3,3,3-tetrafluoro-2-propoxypropanoic acid;hydrochloride
CID 88623979
ethyl 5-amino-4,4-difluoro-5-oxopentanoate
CID 86647023
acetic acid;2,2,2-trifluoroacetamide
CID 172805732
ethyl 3,4,4,4-tetrafluoro-3-(trifluoromethyl)butanoate
CID 170871932
ethyl 3,3,3-trifluoro-2,2-dihydroxypropanoate
CID 154013298
ethyl 2,2-difluoro-2-(2-methoxyethoxy)acetate
CID 66455007
2-fluoro-4-methyl-2-propan-2-ylhexanamide
CID 139916528
diethyl 2-fluoro-2-propan-2-ylpropanedioate
CID 88536481
ethyl N-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)carbamate
CID 2779778

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2,3,3,3-tetrafluoropropanamide?
The IUPAC name of 2-ethoxy-2,3,3,3-tetrafluoropropanamide (CID 2802176) is 2-ethoxy-2,3,3,3-tetrafluoropropanamide.
What is the SMILES notation for 2-ethoxy-2,3,3,3-tetrafluoropropanamide?
The canonical SMILES for 2-ethoxy-2,3,3,3-tetrafluoropropanamide is CCOC(F)(C(N)=O)C(F)(F)F.
What is the InChIKey of 2-ethoxy-2,3,3,3-tetrafluoropropanamide?
The InChIKey is LPKUKZHFTQYNDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F4NO2/c1-2-12-4(6,3(10)11)5(7,8)9/h2H2,1H3,(H2,10,11).
What are the key properties of 2-ethoxy-2,3,3,3-tetrafluoropropanamide?
2-ethoxy-2,3,3,3-tetrafluoropropanamide has a molecular weight of 189.11 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2,3,3,3-tetrafluoropropanamide is sourced from PubChem (CID 2802176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).