2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide

C21H27NO2 — CID 19168145

IUPAC2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)COc1cc(C)ccc1C(C)(C)C
InChIInChI=1S/C21H27NO2/c1-6-16-9-7-8-10-18(16)22-20(23)14-24-19-13-15(2)11-12-17(19)21(3,4)5/h7-13H,6,14H2,1-5H3,(H,22,23)
InChIKeyOSQMAXYVDMRRMQ-UHFFFAOYSA-N
MW325.45 g/mol
LogP4.87
Rot. Bonds5

About 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide

2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide (PubChem CID 19168145) has the molecular formula C21H27NO2 and a molecular weight of 325.45 g/mol. Its IUPAC name is 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide
PubChem CID19168145
Molecular FormulaC21H27NO2
Molecular Weight325.45 g/mol
Exact Mass325.20
IUPAC Name2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)COc1cc(C)ccc1C(C)(C)C
InChIInChI=1S/C21H27NO2/c1-6-16-9-7-8-10-18(16)22-20(23)14-24-19-13-15(2)11-12-17(19)21(3,4)5/h7-13H,6,14H2,1-5H3,(H,22,23)
InChIKeyOSQMAXYVDMRRMQ-UHFFFAOYSA-N
XLogP4.87
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.45
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-tert-butyl-5-methylphenoxy)-N-(2-chlorophenyl)acetamide
CID 725942
2-(2-tert-butyl-5-methylphenoxy)-N-methylacetamide
CID 19168129
N-(2-ethylphenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 5102467
2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide
CID 675188
2-(2,5-dimethylphenoxy)-N-[2-(ethylaminomethyl)phenyl]acetamide;hydrochloride
CID 119440106
2-(2,5-dimethylphenoxy)-N-[2-(ethoxymethyl)phenyl]acetamide
CID 86821690
2-(2,5-dimethylphenoxy)-N-[2-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]acetamide
CID 1012654
2-(3-tert-butylphenoxy)-N-(2-ethylphenyl)acetamide
CID 112977620
methyl 2-[[2-(2-tert-butyl-4-methylphenoxy)acetyl]amino]benzoate
CID 19169245
2-(2-acetamidophenoxy)-N-(2-ethylphenyl)acetamide
CID 7867330
N-(2-ethylphenyl)-2-(2-propoxyphenoxy)acetamide
CID 7750885
2-(2-tert-butyl-5-methylphenoxy)-1-phenylethanone
CID 43426881

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide?
The IUPAC name of 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide (CID 19168145) is 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide.
What is the SMILES notation for 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide?
The canonical SMILES for 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide is CCc1ccccc1NC(=O)COc1cc(C)ccc1C(C)(C)C.
What is the InChIKey of 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide?
The InChIKey is OSQMAXYVDMRRMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO2/c1-6-16-9-7-8-10-18(16)22-20(23)14-24-19-13-15(2)11-12-17(19)21(3,4)5/h7-13H,6,14H2,1-5H3,(H,22,23).
What are the key properties of 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide?
2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide has a molecular weight of 325.45 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide is sourced from PubChem (CID 19168145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).