N-(2-ethylbutyl)-2-phenoxyacetamide

C14H21NO2 — CID 115612512

IUPACN-(2-ethylbutyl)-2-phenoxyacetamide
SMILESCCC(CC)CNC(=O)COc1ccccc1
InChIInChI=1S/C14H21NO2/c1-3-12(4-2)10-15-14(16)11-17-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,15,16)
InChIKeyLRUSNZOIRCVODZ-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.62
Rot. Bonds7

About N-(2-ethylbutyl)-2-phenoxyacetamide

N-(2-ethylbutyl)-2-phenoxyacetamide (PubChem CID 115612512) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(2-ethylbutyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(2-ethylbutyl)-2-phenoxyacetamide
PubChem CID115612512
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-(2-ethylbutyl)-2-phenoxyacetamide
SMILESCCC(CC)CNC(=O)COc1ccccc1
InChIInChI=1S/C14H21NO2/c1-3-12(4-2)10-15-14(16)11-17-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,15,16)
InChIKeyLRUSNZOIRCVODZ-UHFFFAOYSA-N
XLogP2.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylbutyl)-2-(2-methoxyphenoxy)acetamide
CID 115612569
3-[[[2-(4-methylphenoxy)acetyl]amino]methyl]pentanoic acid
CID 81065403
N-(3-hydroxy-2-methylpropyl)-2-phenoxyacetamide
CID 65032139
3-[[[2-(4-ethylphenoxy)acetyl]amino]methyl]pentanoic acid
CID 81065749
2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide
CID 115612647
methyl 2-bromo-3-[(2-phenoxyacetyl)amino]propanoate
CID 103492482
N-[2-(diethylamino)propyl]-2-(4-phenoxyphenoxy)acetamide
CID 46433016
N-(4-bromo-2-methylbutyl)-2-phenoxyacetamide
CID 114316800
N-(hydroxymethyl)-2-phenoxyacetamide
CID 12769641
N-(2-amino-4,4-dimethylpentyl)-2-phenoxyacetamide
CID 107158440
N-(2-ethylhexyl)-2-naphthalen-2-yloxyacetamide
CID 5172128
N-[(2S)-2-ethylhexyl]-2-(4-fluorophenoxy)acetamide
CID 97038167

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-2-phenoxyacetamide?
The IUPAC name of N-(2-ethylbutyl)-2-phenoxyacetamide (CID 115612512) is N-(2-ethylbutyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(2-ethylbutyl)-2-phenoxyacetamide?
The canonical SMILES for N-(2-ethylbutyl)-2-phenoxyacetamide is CCC(CC)CNC(=O)COc1ccccc1.
What is the InChIKey of N-(2-ethylbutyl)-2-phenoxyacetamide?
The InChIKey is LRUSNZOIRCVODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-3-12(4-2)10-15-14(16)11-17-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,15,16).
What are the key properties of N-(2-ethylbutyl)-2-phenoxyacetamide?
N-(2-ethylbutyl)-2-phenoxyacetamide has a molecular weight of 235.33 g/mol, XLogP of 2.62, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-2-phenoxyacetamide is sourced from PubChem (CID 115612512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).