2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide

C18H19Cl2NO2 — CID 3380157

IUPAC2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide
SMILESCC(C)(C)c1ccc(OCC(=O)Nc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO2/c1-18(2,3)12-4-7-14(8-5-12)23-11-17(22)21-16-9-6-13(19)10-15(16)20/h4-10H,11H2,1-3H3,(H,21,22)
InChIKeyHKQWPJZFZHWIOM-UHFFFAOYSA-N
MW352.26 g/mol
LogP5.31
Rot. Bonds4

About 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide

2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide (PubChem CID 3380157) has the molecular formula C18H19Cl2NO2 and a molecular weight of 352.26 g/mol. Its IUPAC name is 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide
PubChem CID3380157
Molecular FormulaC18H19Cl2NO2
Molecular Weight352.26 g/mol
Exact Mass351.08
IUPAC Name2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide
SMILESCC(C)(C)c1ccc(OCC(=O)Nc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO2/c1-18(2,3)12-4-7-14(8-5-12)23-11-17(22)21-16-9-6-13(19)10-15(16)20/h4-10H,11H2,1-3H3,(H,21,22)
InChIKeyHKQWPJZFZHWIOM-UHFFFAOYSA-N
XLogP5.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.26
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-4-chlorophenyl)-2-(4-tert-butylphenoxy)acetamide
CID 91688991
N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 2515961
N-(2,4-dichlorophenyl)-2-(4-octoxyphenoxy)acetamide
CID 4733017
2-[4-[(2R)-butan-2-yl]phenoxy]-N-(2,4-dichlorophenyl)acetamide
CID 40666473
[2-(2,4-dichloroanilino)-2-oxoethyl] 2-(4-chlorophenoxy)acetate
CID 7750749
2-[4-(4-cyanophenyl)phenoxy]-N-(2,4-dichlorophenyl)acetamide
CID 1034300
N-(2,4-dichlorophenyl)-2-methoxyacetamide
CID 885676
N-(2-amino-4-ethoxyphenyl)-2-(4-tert-butylphenoxy)acetamide
CID 91689000
2-(4-tert-butylphenoxy)-N-(2-fluoro-4-iodophenyl)acetamide
CID 2979931
N-(5-chloro-2-methylphenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17093280
2-(4-tert-butylphenyl)sulfanyl-N-(2,4-dichlorophenyl)acetamide
CID 5197742
N-(2,4-dichlorophenyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19178144

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide?
The IUPAC name of 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide (CID 3380157) is 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide?
The canonical SMILES for 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide is CC(C)(C)c1ccc(OCC(=O)Nc2ccc(Cl)cc2Cl)cc1.
What is the InChIKey of 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide?
The InChIKey is HKQWPJZFZHWIOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO2/c1-18(2,3)12-4-7-14(8-5-12)23-11-17(22)21-16-9-6-13(19)10-15(16)20/h4-10H,11H2,1-3H3,(H,21,22).
What are the key properties of 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide?
2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide has a molecular weight of 352.26 g/mol, XLogP of 5.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide is sourced from PubChem (CID 3380157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).