N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide

C6H9F2NO2 — CID 156678165

IUPACN-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide
SMILESCCN(C(=O)CF)C(=O)CF
InChIInChI=1S/C6H9F2NO2/c1-2-9(5(10)3-7)6(11)4-8/h2-4H2,1H3
InChIKeyWXURHZNDXQEZBY-UHFFFAOYSA-N
MW165.14 g/mol
LogP0.30
Rot. Bonds3

About N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide

N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide (PubChem CID 156678165) has the molecular formula C6H9F2NO2 and a molecular weight of 165.14 g/mol. Its IUPAC name is N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide
PubChem CID156678165
Molecular FormulaC6H9F2NO2
Molecular Weight165.14 g/mol
Exact Mass165.06
IUPAC NameN-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide
SMILESCCN(C(=O)CF)C(=O)CF
InChIInChI=1S/C6H9F2NO2/c1-2-9(5(10)3-7)6(11)4-8/h2-4H2,1H3
InChIKeyWXURHZNDXQEZBY-UHFFFAOYSA-N
XLogP0.30
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.14
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide?
The IUPAC name of N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide (CID 156678165) is N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide.
What is the SMILES notation for N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide?
The canonical SMILES for N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide is CCN(C(=O)CF)C(=O)CF.
What is the InChIKey of N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide?
The InChIKey is WXURHZNDXQEZBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F2NO2/c1-2-9(5(10)3-7)6(11)4-8/h2-4H2,1H3.
What are the key properties of N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide?
N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide has a molecular weight of 165.14 g/mol, XLogP of 0.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-fluoro-N-(2-fluoroacetyl)acetamide is sourced from PubChem (CID 156678165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).