2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide

C24H33NO3 — CID 17098209

IUPAC2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide
SMILESCCOc1cccc(NC(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)c1
InChIInChI=1S/C24H33NO3/c1-8-27-19-11-9-10-18(15-19)25-22(26)16-28-21-13-12-17(23(2,3)4)14-20(21)24(5,6)7/h9-15H,8,16H2,1-7H3,(H,25,26)
InChIKeyQVDVIVGUVPOAIP-UHFFFAOYSA-N
MW383.53 g/mol
LogP5.70
Rot. Bonds6

About 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide

2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide (PubChem CID 17098209) has the molecular formula C24H33NO3 and a molecular weight of 383.53 g/mol. Its IUPAC name is 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide
PubChem CID17098209
Molecular FormulaC24H33NO3
Molecular Weight383.53 g/mol
Exact Mass383.25
IUPAC Name2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide
SMILESCCOc1cccc(NC(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)c1
InChIInChI=1S/C24H33NO3/c1-8-27-19-11-9-10-18(15-19)25-22(26)16-28-21-13-12-17(23(2,3)4)14-20(21)24(5,6)7/h9-15H,8,16H2,1-7H3,(H,25,26)
InChIKeyQVDVIVGUVPOAIP-UHFFFAOYSA-N
XLogP5.70
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.53
LogP ≤ 55.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-ditert-butylphenoxy)-N-(3-propoxyphenyl)acetamide
CID 17096794
N-(3-acetylphenyl)-2-(2,4-ditert-butylphenoxy)acetamide
CID 17356505
N-[3-[[2-(2,4-ditert-butylphenoxy)acetyl]amino]phenyl]benzamide
CID 17234915
N-(3-ethoxyphenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17098223
2-(2,4-ditert-butylphenoxy)-N-(4-phenoxyphenyl)acetamide
CID 17356474
2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide
CID 34870464
2-(4-bromo-2-tert-butylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 1184414
2-ethoxy-N-(3-ethoxyphenyl)acetamide
CID 61062065
2-(2-bromo-4-tert-butylphenoxy)-N-(3-prop-2-enoxyphenyl)acetamide
CID 17086768
2-(3-ethoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 112977809
N-(3-ethoxyphenyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 87027979
propyl 4-[[2-(2,4-ditert-butylphenoxy)acetyl]amino]benzoate
CID 17356495

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide?
The IUPAC name of 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide (CID 17098209) is 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide is CCOc1cccc(NC(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)c1.
What is the InChIKey of 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide?
The InChIKey is QVDVIVGUVPOAIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33NO3/c1-8-27-19-11-9-10-18(15-19)25-22(26)16-28-21-13-12-17(23(2,3)4)14-20(21)24(5,6)7/h9-15H,8,16H2,1-7H3,(H,25,26).
What are the key properties of 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide?
2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide has a molecular weight of 383.53 g/mol, XLogP of 5.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide is sourced from PubChem (CID 17098209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).