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

C14H9Br2ClFNO2 — CID 30795617

IUPAC2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Br)Nc1ccc(Br)cc1F
InChIInChI=1S/C14H9Br2ClFNO2/c15-8-1-3-12(11(18)5-8)19-14(20)7-21-13-4-2-9(17)6-10(13)16/h1-6H,7H2,(H,19,20)
InChIKeyVLFZZWVZQNAEFG-UHFFFAOYSA-N
MW437.49 g/mol
LogP5.02
Rot. Bonds4

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

2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide (PubChem CID 30795617) has the molecular formula C14H9Br2ClFNO2 and a molecular weight of 437.49 g/mol. Its IUPAC name is 2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide
PubChem CID30795617
Molecular FormulaC14H9Br2ClFNO2
Molecular Weight437.49 g/mol
Exact Mass434.87
IUPAC Name2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Br)Nc1ccc(Br)cc1F
InChIInChI=1S/C14H9Br2ClFNO2/c15-8-1-3-12(11(18)5-8)19-14(20)7-21-13-4-2-9(17)6-10(13)16/h1-6H,7H2,(H,19,20)
InChIKeyVLFZZWVZQNAEFG-UHFFFAOYSA-N
XLogP5.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.49
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-4-chlorophenoxy)-N-(2-fluorophenyl)acetamide
CID 2627508
2-(2,4-dibromophenoxy)-N-(2,4-difluorophenyl)acetamide
CID 2632796
N-(4-chloro-2-methylphenyl)-2-(2,4-dibromophenoxy)acetamide
CID 1189036
N-(4-bromo-2-fluorophenyl)-2-(3-chloro-4-fluorophenoxy)acetamide
CID 4270758
2-(4-bromo-2-fluorophenoxy)-N-(2,4-difluorophenyl)acetamide
CID 2523027
N-(4-amino-2-chlorophenyl)-2-(2-bromo-4-chlorophenoxy)acetamide
CID 28510783
[2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 2-(4-chloro-2-methylphenoxy)acetate
CID 35564996
N-(4-amino-2-chlorophenyl)-2-(4-bromo-2-fluorophenoxy)acetamide
CID 28971332
2-(2-bromo-4-fluorophenoxy)-N-(2,5-dichlorophenyl)acetamide
CID 7899911
2-(4-bromo-2-fluorophenoxy)-N-(2-bromo-4-methylphenyl)acetamide
CID 26524063
N-(4-bromo-2-fluorophenyl)-2-(2,4-dichloro-6-methylphenoxy)acetamide
CID 2275203
2-(2-bromo-4-chlorophenoxy)-N-(3-bromophenyl)acetamide
CID 19202088

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide?
The IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide (CID 30795617) is 2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide is O=C(COc1ccc(Cl)cc1Br)Nc1ccc(Br)cc1F.
What is the InChIKey of 2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide?
The InChIKey is VLFZZWVZQNAEFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Br2ClFNO2/c15-8-1-3-12(11(18)5-8)19-14(20)7-21-13-4-2-9(17)6-10(13)16/h1-6H,7H2,(H,19,20).
What are the key properties of 2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide?
2-(2-bromo-4-chlorophenoxy)-N-(4-bromo-2-fluorophenyl)acetamide has a molecular weight of 437.49 g/mol, XLogP of 5.02, 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-(4-bromo-2-fluorophenyl)acetamide is sourced from PubChem (CID 30795617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).