N-(4-bromo-2,6-difluorophenyl)acetamide

C8H6BrF2NO — CID 2804166

IUPACN-(4-bromo-2,6-difluorophenyl)acetamide
SMILESCC(=O)Nc1c(F)cc(Br)cc1F
InChIInChI=1S/C8H6BrF2NO/c1-4(13)12-8-6(10)2-5(9)3-7(8)11/h2-3H,1H3,(H,12,13)
InChIKeyOXMOETOVMNVVOM-UHFFFAOYSA-N
MW250.04 g/mol
LogP2.69
Rot. Bonds1

About N-(4-bromo-2,6-difluorophenyl)acetamide

N-(4-bromo-2,6-difluorophenyl)acetamide (PubChem CID 2804166) has the molecular formula C8H6BrF2NO and a molecular weight of 250.04 g/mol. Its IUPAC name is N-(4-bromo-2,6-difluorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-bromo-2,6-difluorophenyl)acetamide
PubChem CID2804166
Molecular FormulaC8H6BrF2NO
Molecular Weight250.04 g/mol
Exact Mass248.96
IUPAC NameN-(4-bromo-2,6-difluorophenyl)acetamide
SMILESCC(=O)Nc1c(F)cc(Br)cc1F
InChIInChI=1S/C8H6BrF2NO/c1-4(13)12-8-6(10)2-5(9)3-7(8)11/h2-3H,1H3,(H,12,13)
InChIKeyOXMOETOVMNVVOM-UHFFFAOYSA-N
XLogP2.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.04
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2,6-difluorophenyl)acetamide?
The IUPAC name of N-(4-bromo-2,6-difluorophenyl)acetamide (CID 2804166) is N-(4-bromo-2,6-difluorophenyl)acetamide.
What is the SMILES notation for N-(4-bromo-2,6-difluorophenyl)acetamide?
The canonical SMILES for N-(4-bromo-2,6-difluorophenyl)acetamide is CC(=O)Nc1c(F)cc(Br)cc1F.
What is the InChIKey of N-(4-bromo-2,6-difluorophenyl)acetamide?
The InChIKey is OXMOETOVMNVVOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6BrF2NO/c1-4(13)12-8-6(10)2-5(9)3-7(8)11/h2-3H,1H3,(H,12,13).
What are the key properties of N-(4-bromo-2,6-difluorophenyl)acetamide?
N-(4-bromo-2,6-difluorophenyl)acetamide has a molecular weight of 250.04 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2,6-difluorophenyl)acetamide is sourced from PubChem (CID 2804166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).