2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide

C18H19Cl2NO2 — CID 7467237

IUPAC2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)COc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C18H19Cl2NO2/c1-3-12-6-5-7-13(4-2)18(12)21-17(22)11-23-16-9-14(19)8-15(20)10-16/h5-10H,3-4,11H2,1-2H3,(H,21,22)
InChIKeyMMOFHDIIORJZMJ-UHFFFAOYSA-N
MW352.26 g/mol
LogP5.14
Rot. Bonds6

About 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide

2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide (PubChem CID 7467237) has the molecular formula C18H19Cl2NO2 and a molecular weight of 352.26 g/mol. Its IUPAC name is 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide.

Molecular Properties

Compound Name2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide
PubChem CID7467237
Molecular FormulaC18H19Cl2NO2
Molecular Weight352.26 g/mol
Exact Mass351.08
IUPAC Name2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)COc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C18H19Cl2NO2/c1-3-12-6-5-7-13(4-2)18(12)21-17(22)11-23-16-9-14(19)8-15(20)10-16/h5-10H,3-4,11H2,1-2H3,(H,21,22)
InChIKeyMMOFHDIIORJZMJ-UHFFFAOYSA-N
XLogP5.14
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.26
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-dimethylphenoxy)-N-(2-ethyl-6-methylphenyl)acetamide
CID 769435
2-(3-acetamidophenoxy)-N-(2,6-diethylphenyl)acetamide
CID 7697860
2-(2,4-dichloro-6-formylphenoxy)-N-(2,6-diethylphenyl)acetamide
CID 28913352
2-(4-acetamidophenoxy)-N-(2,6-diethylphenyl)acetamide
CID 2606243
N-(2,6-diethylphenyl)-2-(4-formylphenoxy)acetamide
CID 23409164
2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-(2,6-diethylphenyl)acetamide
CID 4024458
2-[4-[(2S)-butan-2-yl]phenoxy]-N-(2,6-diethylphenyl)acetamide
CID 7643309
N-(2,6-diethylphenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)acetamide
CID 17396613
N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 7467725
N-(2,6-diethylphenyl)-2-[4-(3-oxobutyl)phenoxy]acetamide
CID 7643132
2-(3,5-dichlorophenoxy)-N-methylacetamide
CID 7848470
2-(4-chloro-3-ethylphenoxy)-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 16545130

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide?
The IUPAC name of 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide (CID 7467237) is 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide.
What is the SMILES notation for 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide?
The canonical SMILES for 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide is CCc1cccc(CC)c1NC(=O)COc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide?
The InChIKey is MMOFHDIIORJZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO2/c1-3-12-6-5-7-13(4-2)18(12)21-17(22)11-23-16-9-14(19)8-15(20)10-16/h5-10H,3-4,11H2,1-2H3,(H,21,22).
What are the key properties of 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide?
2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide has a molecular weight of 352.26 g/mol, XLogP of 5.14, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide is sourced from PubChem (CID 7467237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).