2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide

C15H12BrClFNO2 — CID 2627396

IUPAC2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
SMILESCc1ccc(F)cc1NC(=O)COc1ccc(Cl)cc1Br
InChIInChI=1S/C15H12BrClFNO2/c1-9-2-4-11(18)7-13(9)19-15(20)8-21-14-5-3-10(17)6-12(14)16/h2-7H,8H2,1H3,(H,19,20)
InChIKeySCTZHMTWOZSZAI-UHFFFAOYSA-N
MW372.62 g/mol
LogP4.57
Rot. Bonds4

About 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide

2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide (PubChem CID 2627396) has the molecular formula C15H12BrClFNO2 and a molecular weight of 372.62 g/mol. Its IUPAC name is 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
PubChem CID2627396
Molecular FormulaC15H12BrClFNO2
Molecular Weight372.62 g/mol
Exact Mass370.97
IUPAC Name2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
SMILESCc1ccc(F)cc1NC(=O)COc1ccc(Cl)cc1Br
InChIInChI=1S/C15H12BrClFNO2/c1-9-2-4-11(18)7-13(9)19-15(20)8-21-14-5-3-10(17)6-12(14)16/h2-7H,8H2,1H3,(H,19,20)
InChIKeySCTZHMTWOZSZAI-UHFFFAOYSA-N
XLogP4.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.62
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide (CID 2627396) is 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide is Cc1ccc(F)cc1NC(=O)COc1ccc(Cl)cc1Br.
What is the InChIKey of 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The InChIKey is SCTZHMTWOZSZAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrClFNO2/c1-9-2-4-11(18)7-13(9)19-15(20)8-21-14-5-3-10(17)6-12(14)16/h2-7H,8H2,1H3,(H,19,20).
What are the key properties of 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide has a molecular weight of 372.62 g/mol, XLogP of 4.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-chlorophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide is sourced from PubChem (CID 2627396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).