2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide

C10H9BrFNO3 — CID 75503076

IUPAC2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide
SMILESCC(=O)c1cc(Br)cc(F)c1OCC(N)=O
InChIInChI=1S/C10H9BrFNO3/c1-5(14)7-2-6(11)3-8(12)10(7)16-4-9(13)15/h2-3H,4H2,1H3,(H2,13,15)
InChIKeyFTLUSOCXBLEEAP-UHFFFAOYSA-N
MW290.09 g/mol
LogP1.65
Rot. Bonds4

About 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide

2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide (PubChem CID 75503076) has the molecular formula C10H9BrFNO3 and a molecular weight of 290.09 g/mol. Its IUPAC name is 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide.

Molecular Properties

Compound Name2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide
PubChem CID75503076
Molecular FormulaC10H9BrFNO3
Molecular Weight290.09 g/mol
Exact Mass288.97
IUPAC Name2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide
SMILESCC(=O)c1cc(Br)cc(F)c1OCC(N)=O
InChIInChI=1S/C10H9BrFNO3/c1-5(14)7-2-6(11)3-8(12)10(7)16-4-9(13)15/h2-3H,4H2,1H3,(H2,13,15)
InChIKeyFTLUSOCXBLEEAP-UHFFFAOYSA-N
XLogP1.65
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.09
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide?
The IUPAC name of 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide (CID 75503076) is 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide.
What is the SMILES notation for 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide?
The canonical SMILES for 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide is CC(=O)c1cc(Br)cc(F)c1OCC(N)=O.
What is the InChIKey of 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide?
The InChIKey is FTLUSOCXBLEEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrFNO3/c1-5(14)7-2-6(11)3-8(12)10(7)16-4-9(13)15/h2-3H,4H2,1H3,(H2,13,15).
What are the key properties of 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide?
2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide has a molecular weight of 290.09 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-4-bromo-6-fluorophenoxy)acetamide is sourced from PubChem (CID 75503076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).