2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide

C12H8F3NO2 — CID 168525338

IUPAC2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide
SMILESO=C(Nc1ccc(-c2ccco2)cc1)C(F)(F)F
InChIInChI=1S/C12H8F3NO2/c13-12(14,15)11(17)16-9-5-3-8(4-6-9)10-2-1-7-18-10/h1-7H,(H,16,17)
InChIKeyLAMKWILYRDADKP-UHFFFAOYSA-N
MW255.20 g/mol
LogP3.45
Rot. Bonds2

About 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide

2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide (PubChem CID 168525338) has the molecular formula C12H8F3NO2 and a molecular weight of 255.20 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide
PubChem CID168525338
Molecular FormulaC12H8F3NO2
Molecular Weight255.20 g/mol
Exact Mass255.05
IUPAC Name2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide
SMILESO=C(Nc1ccc(-c2ccco2)cc1)C(F)(F)F
InChIInChI=1S/C12H8F3NO2/c13-12(14,15)11(17)16-9-5-3-8(4-6-9)10-2-1-7-18-10/h1-7H,(H,16,17)
InChIKeyLAMKWILYRDADKP-UHFFFAOYSA-N
XLogP3.45
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.20
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide (CID 168525338) is 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide is O=C(Nc1ccc(-c2ccco2)cc1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide?
The InChIKey is LAMKWILYRDADKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F3NO2/c13-12(14,15)11(17)16-9-5-3-8(4-6-9)10-2-1-7-18-10/h1-7H,(H,16,17).
What are the key properties of 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide?
2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide has a molecular weight of 255.20 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[4-(furan-2-yl)phenyl]acetamide is sourced from PubChem (CID 168525338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).