2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide

C15H23NO3 — CID 65114746

IUPAC2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide
SMILESCCOc1ccc(CC(=O)NCC(C)(O)CC)cc1
InChIInChI=1S/C15H23NO3/c1-4-15(3,18)11-16-14(17)10-12-6-8-13(9-7-12)19-5-2/h6-9,18H,4-5,10-11H2,1-3H3,(H,16,17)
InChIKeyIXTAEBNAULXQIK-UHFFFAOYSA-N
MW265.35 g/mol
LogP1.90
Rot. Bonds7

About 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide

2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide (PubChem CID 65114746) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide
PubChem CID65114746
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide
SMILESCCOc1ccc(CC(=O)NCC(C)(O)CC)cc1
InChIInChI=1S/C15H23NO3/c1-4-15(3,18)11-16-14(17)10-12-6-8-13(9-7-12)19-5-2/h6-9,18H,4-5,10-11H2,1-3H3,(H,16,17)
InChIKeyIXTAEBNAULXQIK-UHFFFAOYSA-N
XLogP1.90
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)acetamide
CID 90522997
2-(4-ethoxyphenyl)-N-[2-hydroxy-3-(4-methoxyphenyl)-2-methylpropyl]acetamide
CID 71782036
N-(2,2-difluoro-3-hydroxypropyl)-2-(4-ethoxyphenyl)acetamide
CID 104857620
N-(2-hydroxy-2-methylbutyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 65114973
N-(2,3-dihydroxy-2-methylpropyl)-2-(4-ethoxyphenoxy)acetamide
CID 66170410
2-(4-ethoxyphenoxy)-N-[2-hydroxy-3-(4-methoxyphenyl)-2-methylpropyl]acetamide
CID 90498249
N-(2-hydroxy-2-methylbutyl)-2-phenoxyacetamide
CID 65114465
1-(4-ethoxyanilino)-2-methylbutan-2-ol
CID 114492504
3-(4-aminophenoxy)-N-(2-hydroxy-2-methylbutyl)propanamide
CID 65103759
2-[[2-(4-ethoxyphenyl)acetyl]amino]-2-methylpropanoic acid
CID 61261354
N-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethyl]butanamide
CID 108573115
3-hydroxy-4-[[2-(4-methoxyphenyl)acetyl]amino]-3-methylbutanoic acid
CID 66001117

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide?
The IUPAC name of 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide (CID 65114746) is 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide?
The canonical SMILES for 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide is CCOc1ccc(CC(=O)NCC(C)(O)CC)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide?
The InChIKey is IXTAEBNAULXQIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-4-15(3,18)11-16-14(17)10-12-6-8-13(9-7-12)19-5-2/h6-9,18H,4-5,10-11H2,1-3H3,(H,16,17).
What are the key properties of 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide?
2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide has a molecular weight of 265.35 g/mol, XLogP of 1.90, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-N-(2-hydroxy-2-methylbutyl)acetamide is sourced from PubChem (CID 65114746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).