2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide

C15H13BrFNO4 — CID 7478739

IUPAC2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)COc2ccc(F)cc2Br)cc1O
InChIInChI=1S/C15H13BrFNO4/c1-21-14-5-3-10(7-12(14)19)18-15(20)8-22-13-4-2-9(17)6-11(13)16/h2-7,19H,8H2,1H3,(H,18,20)
InChIKeyGBPIEOKJKGDRFT-UHFFFAOYSA-N
MW370.17 g/mol
LogP3.32
Rot. Bonds5

About 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide

2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide (PubChem CID 7478739) has the molecular formula C15H13BrFNO4 and a molecular weight of 370.17 g/mol. Its IUPAC name is 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide
PubChem CID7478739
Molecular FormulaC15H13BrFNO4
Molecular Weight370.17 g/mol
Exact Mass369.00
IUPAC Name2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)COc2ccc(F)cc2Br)cc1O
InChIInChI=1S/C15H13BrFNO4/c1-21-14-5-3-10(7-12(14)19)18-15(20)8-22-13-4-2-9(17)6-11(13)16/h2-7,19H,8H2,1H3,(H,18,20)
InChIKeyGBPIEOKJKGDRFT-UHFFFAOYSA-N
XLogP3.32
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.17
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-bromo-4-methoxyphenoxy)-N-(4-fluorophenyl)acetamide
CID 104704640
dimethyl 5-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]benzene-1,3-dicarboxylate
CID 2627534
2-(2-bromo-4-fluorophenoxy)-N-(2-chloro-4,5-dimethoxyphenyl)acetamide
CID 16602981
2-(2-bromo-4-fluorophenoxy)-N-(4-methylsulfonylphenyl)acetamide
CID 18077210
N-(3-bromo-4-methoxyphenyl)-2-(2-chlorophenoxy)acetamide
CID 3544904
2-(2-bromo-4-fluorophenoxy)-N-methoxyacetamide
CID 51279328
ethyl 4-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]benzoate
CID 2627574
2-(2-bromo-4-fluorophenoxy)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 40604024
2-(2-bromo-4-fluorophenoxy)-N-(3-methylsulfonylphenyl)acetamide
CID 9354027
methyl 3-bromo-4-[2-(3-fluoroanilino)-2-oxoethoxy]benzoate
CID 36533330
N-(3-chloro-4-methoxyphenyl)-2-(2-hydroxyphenoxy)acetamide
CID 2712886
2-(2-bromo-4-fluorophenoxy)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 4797677

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide?
The IUPAC name of 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide (CID 7478739) is 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide is COc1ccc(NC(=O)COc2ccc(F)cc2Br)cc1O.
What is the InChIKey of 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide?
The InChIKey is GBPIEOKJKGDRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFNO4/c1-21-14-5-3-10(7-12(14)19)18-15(20)8-22-13-4-2-9(17)6-11(13)16/h2-7,19H,8H2,1H3,(H,18,20).
What are the key properties of 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide?
2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide has a molecular weight of 370.17 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-fluorophenoxy)-N-(3-hydroxy-4-methoxyphenyl)acetamide is sourced from PubChem (CID 7478739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).