2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide

C15H13Cl2NO2 — CID 668134

IUPAC2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C15H13Cl2NO2/c1-10-2-5-12(6-3-10)18-15(19)9-20-14-7-4-11(16)8-13(14)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyQXZANJZDOXEGLQ-UHFFFAOYSA-N
MW310.18 g/mol
LogP4.32
Rot. Bonds4

About 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide

2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide (PubChem CID 668134) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide
PubChem CID668134
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC Name2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C15H13Cl2NO2/c1-10-2-5-12(6-3-10)18-15(19)9-20-14-7-4-11(16)8-13(14)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyQXZANJZDOXEGLQ-UHFFFAOYSA-N
XLogP4.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide (CID 668134) is 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide?
The InChIKey is QXZANJZDOXEGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-10-2-5-12(6-3-10)18-15(19)9-20-14-7-4-11(16)8-13(14)17/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide?
2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide has a molecular weight of 310.18 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 668134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).