2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide

C11H15NO3 — CID 177146694

IUPAC2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide
SMILESCC(C)(O)c1ccc(OCC(N)=O)cc1
InChIInChI=1S/C11H15NO3/c1-11(2,14)8-3-5-9(6-4-8)15-7-10(12)13/h3-6,14H,7H2,1-2H3,(H2,12,13)
InChIKeyXFXCGSWNWNCWJE-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.78
Rot. Bonds4

About 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide

2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide (PubChem CID 177146694) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide
PubChem CID177146694
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Name2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide
SMILESCC(C)(O)c1ccc(OCC(N)=O)cc1
InChIInChI=1S/C11H15NO3/c1-11(2,14)8-3-5-9(6-4-8)15-7-10(12)13/h3-6,14H,7H2,1-2H3,(H2,12,13)
InChIKeyXFXCGSWNWNCWJE-UHFFFAOYSA-N
XLogP0.78
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-butoxyphenoxy)acetamide
CID 22974475
CID 88969762
CID 88969762
2-[4-[3-[4-(2-hydroxypropan-2-yl)phenoxy]-2,2-bis[[4-(2-hydroxypropan-2-yl)phenoxy]methyl]propoxy]phenyl]propan-2-ol
CID 165095225
4-(2-amino-2-oxoethoxy)-N-(4-hydroxy-2-methylbutan-2-yl)benzamide
CID 115869881
4-(4-tert-butylphenoxy)butanamide
CID 82041345
2-[4-[(2,2-dimethylpropylamino)methyl]phenoxy]acetamide
CID 61166013
(2-amino-2-oxoethyl) 4-(4-tert-butylphenoxy)butanoate
CID 7147580
2-(4-prop-2-enoxyphenoxy)acetamide
CID 3608594
2-(4-tert-butylphenoxy)acetyl chloride
CID 611195
2-(3-ethoxy-4-ethylphenoxy)acetamide
CID 141024835
potassium;hydride;2-phenoxyacetamide
CID 175513799
tert-butyl N-[[4-(2-amino-2-oxoethoxy)phenyl]methyl]carbamate
CID 54547080

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide?
The IUPAC name of 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide (CID 177146694) is 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide.
What is the SMILES notation for 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide?
The canonical SMILES for 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide is CC(C)(O)c1ccc(OCC(N)=O)cc1.
What is the InChIKey of 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide?
The InChIKey is XFXCGSWNWNCWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-11(2,14)8-3-5-9(6-4-8)15-7-10(12)13/h3-6,14H,7H2,1-2H3,(H2,12,13).
What are the key properties of 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide?
2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide has a molecular weight of 209.25 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-hydroxypropan-2-yl)phenoxy]acetamide is sourced from PubChem (CID 177146694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).