2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide

C18H18Cl2N2O3 — CID 2588764

IUPAC2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESO=C(COc1cc(Cl)ccc1Cl)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C18H18Cl2N2O3/c19-13-1-6-16(20)17(11-13)25-12-18(23)21-14-2-4-15(5-3-14)22-7-9-24-10-8-22/h1-6,11H,7-10,12H2,(H,21,23)
InChIKeyQREIEDOMLOQYRN-UHFFFAOYSA-N
MW381.26 g/mol
LogP3.85
Rot. Bonds5

About 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide

2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 2588764) has the molecular formula C18H18Cl2N2O3 and a molecular weight of 381.26 g/mol. Its IUPAC name is 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide
PubChem CID2588764
Molecular FormulaC18H18Cl2N2O3
Molecular Weight381.26 g/mol
Exact Mass380.07
IUPAC Name2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESO=C(COc1cc(Cl)ccc1Cl)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C18H18Cl2N2O3/c19-13-1-6-16(20)17(11-13)25-12-18(23)21-14-2-4-15(5-3-14)22-7-9-24-10-8-22/h1-6,11H,7-10,12H2,(H,21,23)
InChIKeyQREIEDOMLOQYRN-UHFFFAOYSA-N
XLogP3.85
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.26
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-(2,5-dichlorophenoxy)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 34444546
[2-(4-morpholin-4-ylanilino)-2-oxoethyl] 2-(2-chloro-5-methylphenoxy)acetate
CID 7153111
2-(2,5-dichlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
CID 51139074
2-[[2-(2,4-dichlorophenoxy)acetyl]-methylamino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 4820741
2-(2,4-dichlorophenoxy)-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 979211
2-(2,5-dichlorophenoxy)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide
CID 108762057
4-chloro-2-[2-oxo-2-(4-piperidin-1-ylanilino)ethoxy]benzamide
CID 60601304
N-[4-(azepan-1-yl)phenyl]-2-(2-chlorophenoxy)acetamide
CID 7582236
2-(2-chlorophenoxy)-N-(4-piperidin-1-ylphenyl)acetamide
CID 7922500
2-(2,4-dichlorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 1080666
N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide
CID 675127
N-(4-acetylphenyl)-2-(2,5-dichlorophenoxy)acetamide
CID 724281

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide (CID 2588764) is 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide is O=C(COc1cc(Cl)ccc1Cl)Nc1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is QREIEDOMLOQYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O3/c19-13-1-6-16(20)17(11-13)25-12-18(23)21-14-2-4-15(5-3-14)22-7-9-24-10-8-22/h1-6,11H,7-10,12H2,(H,21,23).
What are the key properties of 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide?
2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 381.26 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenoxy)-N-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 2588764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).