fluoro 2-(4-fluoroanilino)acetate

C8H7F2NO2 — CID 143108358

IUPACfluoro 2-(4-fluoroanilino)acetate
SMILESO=C(CNc1ccc(F)cc1)OF
InChIInChI=1S/C8H7F2NO2/c9-6-1-3-7(4-2-6)11-5-8(12)13-10/h1-4,11H,5H2
InChIKeyGBZFNEARZMEPCA-UHFFFAOYSA-N
MW187.15 g/mol
LogP1.67
Rot. Bonds3

About fluoro 2-(4-fluoroanilino)acetate

fluoro 2-(4-fluoroanilino)acetate (PubChem CID 143108358) has the molecular formula C8H7F2NO2 and a molecular weight of 187.15 g/mol. Its IUPAC name is fluoro 2-(4-fluoroanilino)acetate.

Molecular Properties

Compound Namefluoro 2-(4-fluoroanilino)acetate
PubChem CID143108358
Molecular FormulaC8H7F2NO2
Molecular Weight187.15 g/mol
Exact Mass187.04
IUPAC Namefluoro 2-(4-fluoroanilino)acetate
SMILESO=C(CNc1ccc(F)cc1)OF
InChIInChI=1S/C8H7F2NO2/c9-6-1-3-7(4-2-6)11-5-8(12)13-10/h1-4,11H,5H2
InChIKeyGBZFNEARZMEPCA-UHFFFAOYSA-N
XLogP1.67
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.15
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

prop-2-enyl 2-(4-fluoroanilino)acetate
CID 145294426
N-[4-[[2-(4-fluoroanilino)acetyl]amino]phenyl]propanamide
CID 54813242
N-ethyl-2-(4-fluoroanilino)-N-methylacetamide
CID 43309636
2-(4-fluoroanilino)-N-(2-methylbutan-2-yl)acetamide
CID 60671142
(3S)-3-amino-1-(4-fluoroanilino)-4-phenylbutan-2-one
CID 139721302
N-[4-[[2-(4-fluoroanilino)-2-oxoethyl]amino]phenyl]butanamide
CID 54836956
N-ethyl-3-(4-fluoroanilino)propanamide
CID 62324389
N-[4-[[2-(4-fluoroanilino)acetyl]amino]phenyl]-3-methylbutanamide
CID 54813431
N-(4-cyanophenyl)-2-(4-fluoroanilino)acetamide
CID 9098665
2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide
CID 54811098
4-[(2-methoxy-2-oxoethyl)amino]benzoic acid
CID 898305
1-(2,5-dimethylphenyl)-2-(4-fluoroanilino)ethanone
CID 82120744

Frequently Asked Questions

What is the IUPAC name of fluoro 2-(4-fluoroanilino)acetate?
The IUPAC name of fluoro 2-(4-fluoroanilino)acetate (CID 143108358) is fluoro 2-(4-fluoroanilino)acetate.
What is the SMILES notation for fluoro 2-(4-fluoroanilino)acetate?
The canonical SMILES for fluoro 2-(4-fluoroanilino)acetate is O=C(CNc1ccc(F)cc1)OF.
What is the InChIKey of fluoro 2-(4-fluoroanilino)acetate?
The InChIKey is GBZFNEARZMEPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F2NO2/c9-6-1-3-7(4-2-6)11-5-8(12)13-10/h1-4,11H,5H2.
What are the key properties of fluoro 2-(4-fluoroanilino)acetate?
fluoro 2-(4-fluoroanilino)acetate has a molecular weight of 187.15 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro 2-(4-fluoroanilino)acetate is sourced from PubChem (CID 143108358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).