2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide

C20H23NO4 — CID 2709111

IUPAC2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide
SMILESCOc1ccc(C(C)=O)c(OCC(=O)Nc2ccc(C(C)C)cc2)c1
InChIInChI=1S/C20H23NO4/c1-13(2)15-5-7-16(8-6-15)21-20(23)12-25-19-11-17(24-4)9-10-18(19)14(3)22/h5-11,13H,12H2,1-4H3,(H,21,23)
InChIKeyGKNJAYVFBVVING-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.04
Rot. Bonds7

About 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide

2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide (PubChem CID 2709111) has the molecular formula C20H23NO4 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide
PubChem CID2709111
Molecular FormulaC20H23NO4
Molecular Weight341.41 g/mol
Exact Mass341.16
IUPAC Name2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide
SMILESCOc1ccc(C(C)=O)c(OCC(=O)Nc2ccc(C(C)C)cc2)c1
InChIInChI=1S/C20H23NO4/c1-13(2)15-5-7-16(8-6-15)21-20(23)12-25-19-11-17(24-4)9-10-18(19)14(3)22/h5-11,13H,12H2,1-4H3,(H,21,23)
InChIKeyGKNJAYVFBVVING-UHFFFAOYSA-N
XLogP4.04
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-acetylphenoxy)-N-(4-propan-2-ylphenyl)acetamide
CID 7859306
2-(3,5-dimethoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide
CID 7707185
2-(2-acetyl-5-methoxyphenoxy)-N-(3,4-diethoxyphenyl)acetamide
CID 7688310
[2-oxo-2-(4-propan-2-ylanilino)ethyl] 2,5-dimethoxybenzoate
CID 7586714
2-(2-acetyl-5-methoxyphenoxy)-N-(2-methylpropyl)acetamide
CID 7688307
2-(2-anilino-2-oxoethoxy)-4-methoxybenzoic acid
CID 45418219
2,4-dimethoxy-N-[(Z)-[4-oxo-4-(4-propan-2-ylanilino)butan-2-ylidene]amino]benzamide
CID 6109714
methyl 2-[2-(4-ethylanilino)-2-oxoethoxy]-4-methoxybenzoate
CID 7704975
2-(2-acetyl-5-methoxyphenoxy)-N-[1-(4-fluorophenyl)-2-methylpropyl]acetamide
CID 55467454
4-methoxy-2-[2-(4-methoxycarbonylanilino)-2-oxoethoxy]benzoic acid
CID 45418346
methyl 2-[2-(4-tert-butylanilino)-2-oxoethoxy]-4-methoxybenzoate
CID 7704907
2-(2-acetylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 7859310

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide (CID 2709111) is 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide is COc1ccc(C(C)=O)c(OCC(=O)Nc2ccc(C(C)C)cc2)c1.
What is the InChIKey of 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide?
The InChIKey is GKNJAYVFBVVING-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4/c1-13(2)15-5-7-16(8-6-15)21-20(23)12-25-19-11-17(24-4)9-10-18(19)14(3)22/h5-11,13H,12H2,1-4H3,(H,21,23).
What are the key properties of 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide?
2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide has a molecular weight of 341.41 g/mol, XLogP of 4.04, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-5-methoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 2709111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).