2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide

C19H23NO3 — CID 2872843

IUPAC2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(CCNC(=O)COc2ccc(C)cc2C)cc1
InChIInChI=1S/C19H23NO3/c1-14-4-9-18(15(2)12-14)23-13-19(21)20-11-10-16-5-7-17(22-3)8-6-16/h4-9,12H,10-11,13H2,1-3H3,(H,20,21)
InChIKeyGMSYENSSZAKFJO-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.05
Rot. Bonds7

About 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide

2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide (PubChem CID 2872843) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide
PubChem CID2872843
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(CCNC(=O)COc2ccc(C)cc2C)cc1
InChIInChI=1S/C19H23NO3/c1-14-4-9-18(15(2)12-14)23-13-19(21)20-11-10-16-5-7-17(22-3)8-6-16/h4-9,12H,10-11,13H2,1-3H3,(H,20,21)
InChIKeyGMSYENSSZAKFJO-UHFFFAOYSA-N
XLogP3.05
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide (CID 2872843) is 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide is COc1ccc(CCNC(=O)COc2ccc(C)cc2C)cc1.
What is the InChIKey of 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide?
The InChIKey is GMSYENSSZAKFJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-14-4-9-18(15(2)12-14)23-13-19(21)20-11-10-16-5-7-17(22-3)8-6-16/h4-9,12H,10-11,13H2,1-3H3,(H,20,21).
What are the key properties of 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide?
2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide has a molecular weight of 313.40 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 2872843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).