2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide

C18H18BrClN2O3 — CID 5021138

IUPAC2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Br)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C18H18BrClN2O3/c19-14-11-13(20)5-6-17(14)25-12-18(23)21-15-3-1-2-4-16(15)22-7-9-24-10-8-22/h1-6,11H,7-10,12H2,(H,21,23)
InChIKeyMKICUMLXOQDADJ-UHFFFAOYSA-N
MW425.71 g/mol
LogP3.96
Rot. Bonds5

About 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide

2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 5021138) has the molecular formula C18H18BrClN2O3 and a molecular weight of 425.71 g/mol. Its IUPAC name is 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
PubChem CID5021138
Molecular FormulaC18H18BrClN2O3
Molecular Weight425.71 g/mol
Exact Mass424.02
IUPAC Name2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Br)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C18H18BrClN2O3/c19-14-11-13(20)5-6-17(14)25-12-18(23)21-15-3-1-2-4-16(15)22-7-9-24-10-8-22/h1-6,11H,7-10,12H2,(H,21,23)
InChIKeyMKICUMLXOQDADJ-UHFFFAOYSA-N
XLogP3.96
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.71
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dichlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
CID 51139074
2-(2-bromo-4-fluorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
CID 2627522
2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
CID 1078563
2-(4-chloro-2-methylphenoxy)-N-(5-chloro-2-morpholin-4-ylphenyl)acetamide
CID 3467178
2-(2-bromo-4-chlorophenoxy)-N-(2-fluorophenyl)acetamide
CID 2627508
2-(5-chloro-2-methoxyanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 99144350
N-(5-chloro-2-morpholin-4-ylphenyl)-2-(4-chlorophenoxy)acetamide
CID 4665478
2-(2-bromo-4-chlorophenoxy)-N-[2-(hydroxymethyl)phenyl]acetamide
CID 1213643
2-(2,4-dichlorophenoxy)-N-[2-(morpholin-4-ylmethyl)phenyl]acetamide
CID 55899065
methyl 2-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]benzoate
CID 1213645
2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxyphenyl)acetamide
CID 1367163
2-(4-benzoylphenoxy)-N-(5-chloro-2-morpholin-4-ylphenyl)acetamide
CID 2532185

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide (CID 5021138) is 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide is O=C(COc1ccc(Cl)cc1Br)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is MKICUMLXOQDADJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18BrClN2O3/c19-14-11-13(20)5-6-17(14)25-12-18(23)21-15-3-1-2-4-16(15)22-7-9-24-10-8-22/h1-6,11H,7-10,12H2,(H,21,23).
What are the key properties of 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide?
2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 425.71 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 5021138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).