2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide

C10H10BrFN2O2 — CID 43082449

IUPAC2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide
SMILESCC(=O)NCC(=O)Nc1ccc(Br)cc1F
InChIInChI=1S/C10H10BrFN2O2/c1-6(15)13-5-10(16)14-9-3-2-7(11)4-8(9)12/h2-4H,5H2,1H3,(H,13,15)(H,14,16)
InChIKeyLCBVPIUCZRJSPU-UHFFFAOYSA-N
MW289.10 g/mol
LogP1.66
Rot. Bonds3

About 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide

2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide (PubChem CID 43082449) has the molecular formula C10H10BrFN2O2 and a molecular weight of 289.10 g/mol. Its IUPAC name is 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide
PubChem CID43082449
Molecular FormulaC10H10BrFN2O2
Molecular Weight289.10 g/mol
Exact Mass287.99
IUPAC Name2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide
SMILESCC(=O)NCC(=O)Nc1ccc(Br)cc1F
InChIInChI=1S/C10H10BrFN2O2/c1-6(15)13-5-10(16)14-9-3-2-7(11)4-8(9)12/h2-4H,5H2,1H3,(H,13,15)(H,14,16)
InChIKeyLCBVPIUCZRJSPU-UHFFFAOYSA-N
XLogP1.66
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.10
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide?
The IUPAC name of 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide (CID 43082449) is 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide.
What is the SMILES notation for 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide?
The canonical SMILES for 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide is CC(=O)NCC(=O)Nc1ccc(Br)cc1F.
What is the InChIKey of 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide?
The InChIKey is LCBVPIUCZRJSPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrFN2O2/c1-6(15)13-5-10(16)14-9-3-2-7(11)4-8(9)12/h2-4H,5H2,1H3,(H,13,15)(H,14,16).
What are the key properties of 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide?
2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide has a molecular weight of 289.10 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(4-bromo-2-fluorophenyl)acetamide is sourced from PubChem (CID 43082449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).