2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide

C18H19Br2NO4 — CID 19628723

IUPAC2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide
SMILESCCOCCOc1cccc(NC(=O)COc2ccc(Br)cc2Br)c1
InChIInChI=1S/C18H19Br2NO4/c1-2-23-8-9-24-15-5-3-4-14(11-15)21-18(22)12-25-17-7-6-13(19)10-16(17)20/h3-7,10-11H,2,8-9,12H2,1H3,(H,21,22)
InChIKeyCFGPAAHOPATKNU-UHFFFAOYSA-N
MW473.16 g/mol
LogP4.64
Rot. Bonds9

About 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide

2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide (PubChem CID 19628723) has the molecular formula C18H19Br2NO4 and a molecular weight of 473.16 g/mol. Its IUPAC name is 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide
PubChem CID19628723
Molecular FormulaC18H19Br2NO4
Molecular Weight473.16 g/mol
Exact Mass470.97
IUPAC Name2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide
SMILESCCOCCOc1cccc(NC(=O)COc2ccc(Br)cc2Br)c1
InChIInChI=1S/C18H19Br2NO4/c1-2-23-8-9-24-15-5-3-4-14(11-15)21-18(22)12-25-17-7-6-13(19)10-16(17)20/h3-7,10-11H,2,8-9,12H2,1H3,(H,21,22)
InChIKeyCFGPAAHOPATKNU-UHFFFAOYSA-N
XLogP4.64
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500473.16
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-bromo-2-methylphenoxy)-N-(3-propoxyphenyl)acetamide
CID 17096701
2-(4-bromo-2-methylphenoxy)-N-[3-(2-methoxyethoxy)phenyl]acetamide
CID 17169811
2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide
CID 17096693
2-(2,4-dibromophenoxy)-N-(3-hydroxyphenyl)acetamide
CID 981216
2-(2-bromo-4-phenylphenoxy)-N-[3-(2-methoxyethoxy)phenyl]acetamide
CID 17169893
2-(2-bromo-4-methylphenoxy)-N-(3-heptoxyphenyl)acetamide
CID 17138101
2-(2-bromo-4-ethylphenoxy)-N-[4-(2-ethoxyethoxy)phenyl]acetamide
CID 17130580
2-(2-bromo-4-ethylphenoxy)-N-(3-bromophenyl)acetamide
CID 19202087
2-(4-bromo-2-chlorophenoxy)-N-[3-(2-phenylethoxy)phenyl]acetamide
CID 17142159
ethyl N-[3-[2-(4-bromoanilino)-2-oxoethoxy]phenyl]carbamate
CID 35775899
2-(2-bromo-4-methylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 1008619
2-(2-bromo-4-methylphenoxy)-N-[3-(3-phenylpropoxy)phenyl]acetamide
CID 17133202

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide?
The IUPAC name of 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide (CID 19628723) is 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide is CCOCCOc1cccc(NC(=O)COc2ccc(Br)cc2Br)c1.
What is the InChIKey of 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide?
The InChIKey is CFGPAAHOPATKNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Br2NO4/c1-2-23-8-9-24-15-5-3-4-14(11-15)21-18(22)12-25-17-7-6-13(19)10-16(17)20/h3-7,10-11H,2,8-9,12H2,1H3,(H,21,22).
What are the key properties of 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide?
2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide has a molecular weight of 473.16 g/mol, XLogP of 4.64, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dibromophenoxy)-N-[3-(2-ethoxyethoxy)phenyl]acetamide is sourced from PubChem (CID 19628723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).