N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide

C13H10F3NO3 — CID 54225318

IUPACN-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)NC1=CC(=O)OC1
InChIInChI=1S/C13H10F3NO3/c14-13(15,16)9-3-1-8(2-4-9)5-11(18)17-10-6-12(19)20-7-10/h1-4,6H,5,7H2,(H,17,18)
InChIKeyQFLBHNKWLDTRNP-UHFFFAOYSA-N
MW285.22 g/mol
LogP1.80
Rot. Bonds3

About N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide

N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 54225318) has the molecular formula C13H10F3NO3 and a molecular weight of 285.22 g/mol. Its IUPAC name is N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID54225318
Molecular FormulaC13H10F3NO3
Molecular Weight285.22 g/mol
Exact Mass285.06
IUPAC NameN-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)NC1=CC(=O)OC1
InChIInChI=1S/C13H10F3NO3/c14-13(15,16)9-3-1-8(2-4-9)5-11(18)17-10-6-12(19)20-7-10/h1-4,6H,5,7H2,(H,17,18)
InChIKeyQFLBHNKWLDTRNP-UHFFFAOYSA-N
XLogP1.80
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.22
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-oxo-2H-furan-4-yl)-4-phenylbutanamide
CID 44578157
N-(4-bromo-2-oxo-2,5-dihydrofuran-3-yl)-4-phenylbutanamide
CID 44578159
Methyl 2-[(2-phenylacetyl)amino]prop-2-enoate
CID 286525
ethyl 6-oxo-5-phenyl-2-(trifluoromethyl)-1H-pyridine-3-carboxylate
CID 102051906
(z)-Methyl 3-(2-phenylacetamido)-4-(2,4,5-trifluorophenyl)but-2-enoate
CID 138392438
N-[5-oxo-4-[3-(trifluoromethyl)phenyl]-2H-furan-3-yl]acetamide
CID 19764146
N-(5-oxo-2H-furan-3-yl)-3-(trifluoromethyl)benzamide
CID 53734113
N-(5-oxo-2H-furan-3-yl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 53979171
N-(5-oxo-2H-furan-3-yl)-3,5-bis(trifluoromethyl)benzamide
CID 54014002
2-[3,5-bis(trifluoromethyl)phenyl]-N-(5-oxo-2H-furan-3-yl)acetamide
CID 54070063
2-(2-fluorophenyl)-N-(5-oxo-2H-furan-3-yl)acetamide
CID 54246627
N-[(5-oxo-2H-furan-3-yl)carbamoyl]-4-(trifluoromethyl)benzamide
CID 54306894

Frequently Asked Questions

What is the IUPAC name of N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide (CID 54225318) is N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide is O=C(Cc1ccc(C(F)(F)F)cc1)NC1=CC(=O)OC1.
What is the InChIKey of N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is QFLBHNKWLDTRNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3NO3/c14-13(15,16)9-3-1-8(2-4-9)5-11(18)17-10-6-12(19)20-7-10/h1-4,6H,5,7H2,(H,17,18).
What are the key properties of N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide?
N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 285.22 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-oxo-2H-furan-3-yl)-2-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 54225318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).