2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide

C17H17Cl2NO2 — CID 4883247

IUPAC2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccccc1C(C)NC(=O)Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C17H17Cl2NO2/c1-11(13-5-3-4-6-16(13)22-2)20-17(21)10-12-7-8-14(18)15(19)9-12/h3-9,11H,10H2,1-2H3,(H,20,21)
InChIKeyIEYAPFNIDXNXSB-UHFFFAOYSA-N
MW338.23 g/mol
LogP4.42
Rot. Bonds5

About 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide

2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide (PubChem CID 4883247) has the molecular formula C17H17Cl2NO2 and a molecular weight of 338.23 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide
PubChem CID4883247
Molecular FormulaC17H17Cl2NO2
Molecular Weight338.23 g/mol
Exact Mass337.06
IUPAC Name2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccccc1C(C)NC(=O)Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C17H17Cl2NO2/c1-11(13-5-3-4-6-16(13)22-2)20-17(21)10-12-7-8-14(18)15(19)9-12/h3-9,11H,10H2,1-2H3,(H,20,21)
InChIKeyIEYAPFNIDXNXSB-UHFFFAOYSA-N
XLogP4.42
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.23
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide (CID 4883247) is 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide is COc1ccccc1C(C)NC(=O)Cc1ccc(Cl)c(Cl)c1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide?
The InChIKey is IEYAPFNIDXNXSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2NO2/c1-11(13-5-3-4-6-16(13)22-2)20-17(21)10-12-7-8-14(18)15(19)9-12/h3-9,11H,10H2,1-2H3,(H,20,21).
What are the key properties of 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide?
2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide has a molecular weight of 338.23 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N-[1-(2-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 4883247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).