2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide

C16H25NO2 — CID 115612647

IUPAC2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide
SMILESCCC(CC)CNC(=O)COc1c(C)cccc1C
InChIInChI=1S/C16H25NO2/c1-5-14(6-2)10-17-15(18)11-19-16-12(3)8-7-9-13(16)4/h7-9,14H,5-6,10-11H2,1-4H3,(H,17,18)
InChIKeyGLFHMZPTTQDPBH-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.23
Rot. Bonds7

About 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide

2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide (PubChem CID 115612647) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide
PubChem CID115612647
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide
SMILESCCC(CC)CNC(=O)COc1c(C)cccc1C
InChIInChI=1S/C16H25NO2/c1-5-14(6-2)10-17-15(18)11-19-16-12(3)8-7-9-13(16)4/h7-9,14H,5-6,10-11H2,1-4H3,(H,17,18)
InChIKeyGLFHMZPTTQDPBH-UHFFFAOYSA-N
XLogP3.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylbutyl)-2-phenoxyacetamide
CID 115612512
2-(2,6-dimethylphenoxy)-N-[1,1,2,2-tetradeuterio-2-[[2-(2,6-dimethylphenoxy)acetyl]amino]ethyl]acetamide
CID 171381792
N-(2-ethylbutyl)-2-(2-methoxyphenoxy)acetamide
CID 115612569
N-(2-amino-2-phenylethyl)-2-(2,6-dimethylphenoxy)acetamide
CID 119529545
2-(2,6-dimethylphenoxy)-N-[6-[[2-(2,6-dimethylphenoxy)acetyl]amino]hexyl]acetamide
CID 3463804
2-(2,6-dimethylphenoxy)-N-[2-(2-fluorophenyl)-2-hydroxyethyl]acetamide
CID 111566012
2-(2,6-dimethylphenoxy)-N'-methylacetohydrazide
CID 116820679
N-(3-acetamidopropyl)-2-(2,6-dimethylphenoxy)acetamide
CID 38448955
2-[[2-(2,6-dimethylphenoxy)acetyl]amino]-N-ethylpropanamide
CID 47112988
N-(2-ethylbutyl)-3-(2-methylphenoxy)propanamide
CID 115612578
N-(2-ethylbutyl)-2,6-dimethylbenzamide
CID 103714285
N-[(2R)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-2-(2,6-dimethylphenoxy)acetamide
CID 30521032

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide?
The IUPAC name of 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide (CID 115612647) is 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide.
What is the SMILES notation for 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide?
The canonical SMILES for 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide is CCC(CC)CNC(=O)COc1c(C)cccc1C.
What is the InChIKey of 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide?
The InChIKey is GLFHMZPTTQDPBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-5-14(6-2)10-17-15(18)11-19-16-12(3)8-7-9-13(16)4/h7-9,14H,5-6,10-11H2,1-4H3,(H,17,18).
What are the key properties of 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide?
2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide has a molecular weight of 263.38 g/mol, XLogP of 3.23, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide is sourced from PubChem (CID 115612647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).