2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide

C18H21NO3 — CID 110288618

IUPAC2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide
SMILESCOc1ccccc1OCC(=O)NCCc1cccc(C)c1
InChIInChI=1S/C18H21NO3/c1-14-6-5-7-15(12-14)10-11-19-18(20)13-22-17-9-4-3-8-16(17)21-2/h3-9,12H,10-11,13H2,1-2H3,(H,19,20)
InChIKeyPJTYYIRHYGSVBC-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.74
Rot. Bonds7

About 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide

2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide (PubChem CID 110288618) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide
PubChem CID110288618
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide
SMILESCOc1ccccc1OCC(=O)NCCc1cccc(C)c1
InChIInChI=1S/C18H21NO3/c1-14-6-5-7-15(12-14)10-11-19-18(20)13-22-17-9-4-3-8-16(17)21-2/h3-9,12H,10-11,13H2,1-2H3,(H,19,20)
InChIKeyPJTYYIRHYGSVBC-UHFFFAOYSA-N
XLogP2.74
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide (CID 110288618) is 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide is COc1ccccc1OCC(=O)NCCc1cccc(C)c1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide?
The InChIKey is PJTYYIRHYGSVBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-14-6-5-7-15(12-14)10-11-19-18(20)13-22-17-9-4-3-8-16(17)21-2/h3-9,12H,10-11,13H2,1-2H3,(H,19,20).
What are the key properties of 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide?
2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide has a molecular weight of 299.37 g/mol, XLogP of 2.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[2-(3-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 110288618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).