2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide

C11H8F7NO2 — CID 71384122

IUPAC2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide
SMILESO=C(COC(F)(C(F)(F)F)C(F)(F)F)Nc1ccccc1
InChIInChI=1S/C11H8F7NO2/c12-9(10(13,14)15,11(16,17)18)21-6-8(20)19-7-4-2-1-3-5-7/h1-5H,6H2,(H,19,20)
InChIKeyAULFSFAAKNRJFT-UHFFFAOYSA-N
MW319.18 g/mol
LogP3.43
Rot. Bonds4

About 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide

2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide (PubChem CID 71384122) has the molecular formula C11H8F7NO2 and a molecular weight of 319.18 g/mol. Its IUPAC name is 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide.

Molecular Properties

Compound Name2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide
PubChem CID71384122
Molecular FormulaC11H8F7NO2
Molecular Weight319.18 g/mol
Exact Mass319.04
IUPAC Name2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide
SMILESO=C(COC(F)(C(F)(F)F)C(F)(F)F)Nc1ccccc1
InChIInChI=1S/C11H8F7NO2/c12-9(10(13,14)15,11(16,17)18)21-6-8(20)19-7-4-2-1-3-5-7/h1-5H,6H2,(H,19,20)
InChIKeyAULFSFAAKNRJFT-UHFFFAOYSA-N
XLogP3.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.18
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-aminooxy-N-phenylacetamide
CID 68980997
2-acetamidooxy-N-phenylacetamide
CID 137320659
3,3-difluoro-N-phenylbutanamide
CID 131059355
ethane;2-methoxy-N-phenylacetamide;yttrium
CID 159976159
N-phenyl-2-phenylmethoxyacetamide
CID 15220156
bis(2-anilino-2-oxoethyl) (E)-but-2-enedioate
CID 9010738
(2-anilino-2-oxoethyl) 3,3-diphenylpropanoate
CID 7795395
3-fluoro-N-phenylpropanamide
CID 70366284
2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide
CID 35270563
2-(4-tert-butylphenoxy)-N-phenylacetamide
CID 963342
(2-anilino-2-oxoethyl)sulfanium
CID 153278909
(2-anilino-2-oxoethyl) furan-2-carboxylate
CID 2352919

Frequently Asked Questions

What is the IUPAC name of 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide?
The IUPAC name of 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide (CID 71384122) is 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide.
What is the SMILES notation for 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide?
The canonical SMILES for 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide is O=C(COC(F)(C(F)(F)F)C(F)(F)F)Nc1ccccc1.
What is the InChIKey of 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide?
The InChIKey is AULFSFAAKNRJFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F7NO2/c12-9(10(13,14)15,11(16,17)18)21-6-8(20)19-7-4-2-1-3-5-7/h1-5H,6H2,(H,19,20).
What are the key properties of 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide?
2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide has a molecular weight of 319.18 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)-N-phenylacetamide is sourced from PubChem (CID 71384122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).