N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide

C15H13Cl2NO3 — CID 809051

IUPACN-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide
SMILESCOc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C15H13Cl2NO3/c1-20-11-3-5-12(6-4-11)21-9-15(19)18-10-2-7-13(16)14(17)8-10/h2-8H,9H2,1H3,(H,18,19)
InChIKeyWYHQXEGQEZLHIH-UHFFFAOYSA-N
MW326.18 g/mol
LogP4.02
Rot. Bonds5

About N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide

N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide (PubChem CID 809051) has the molecular formula C15H13Cl2NO3 and a molecular weight of 326.18 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide
PubChem CID809051
Molecular FormulaC15H13Cl2NO3
Molecular Weight326.18 g/mol
Exact Mass325.03
IUPAC NameN-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide
SMILESCOc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C15H13Cl2NO3/c1-20-11-3-5-12(6-4-11)21-9-15(19)18-10-2-7-13(16)14(17)8-10/h2-8H,9H2,1H3,(H,18,19)
InChIKeyWYHQXEGQEZLHIH-UHFFFAOYSA-N
XLogP4.02
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.18
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide (CID 809051) is N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide is COc1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide?
The InChIKey is WYHQXEGQEZLHIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO3/c1-20-11-3-5-12(6-4-11)21-9-15(19)18-10-2-7-13(16)14(17)8-10/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide?
N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide has a molecular weight of 326.18 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-(4-methoxyphenoxy)acetamide is sourced from PubChem (CID 809051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).