2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide

C12H17NO4 — CID 115410289

IUPAC2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide
SMILESCC(C)CONC(=O)COc1ccccc1O
InChIInChI=1S/C12H17NO4/c1-9(2)7-17-13-12(15)8-16-11-6-4-3-5-10(11)14/h3-6,9,14H,7-8H2,1-2H3,(H,13,15)
InChIKeyULSWJEUIZQVTSF-UHFFFAOYSA-N
MW239.27 g/mol
LogP1.47
Rot. Bonds6

About 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide

2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide (PubChem CID 115410289) has the molecular formula C12H17NO4 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide
PubChem CID115410289
Molecular FormulaC12H17NO4
Molecular Weight239.27 g/mol
Exact Mass239.12
IUPAC Name2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide
SMILESCC(C)CONC(=O)COc1ccccc1O
InChIInChI=1S/C12H17NO4/c1-9(2)7-17-13-12(15)8-16-11-6-4-3-5-10(11)14/h3-6,9,14H,7-8H2,1-2H3,(H,13,15)
InChIKeyULSWJEUIZQVTSF-UHFFFAOYSA-N
XLogP1.47
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-hydroxyphenoxy)-N-(2-methylpropyl)acetamide
CID 43087121
2-(2-chloro-4-fluorophenoxy)-N-(2-methylpropoxy)acetamide
CID 115410094
N-(2-hydroxy-4-methylpentyl)-2-(2-hydroxyphenoxy)acetamide
CID 103822650
2-(2-hydroxyphenoxy)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 78771813
2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide
CID 78813413
2-(2-hydroxyphenoxy)-N-(2-propan-2-ylphenyl)acetamide
CID 78781647
2-(2-hydroxyphenoxy)-N-(1-naphthalen-1-ylethyl)acetamide
CID 78777927
3-(2-hydroxyphenoxy)-2-methylpropanamide
CID 43312348
2-(2-hydroxyphenoxy)acetamide
CID 786426
2-(2-methylphenyl)-N-(2-methylpropoxy)acetamide
CID 115409697
N-ethoxy-2-(2-fluorophenoxy)acetamide
CID 60712120
2-[[2-(2-hydroxyphenoxy)acetyl]amino]-2-phenylacetamide
CID 78840056

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide?
The IUPAC name of 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide (CID 115410289) is 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide.
What is the SMILES notation for 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide?
The canonical SMILES for 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide is CC(C)CONC(=O)COc1ccccc1O.
What is the InChIKey of 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide?
The InChIKey is ULSWJEUIZQVTSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO4/c1-9(2)7-17-13-12(15)8-16-11-6-4-3-5-10(11)14/h3-6,9,14H,7-8H2,1-2H3,(H,13,15).
What are the key properties of 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide?
2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide has a molecular weight of 239.27 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenoxy)-N-(2-methylpropoxy)acetamide is sourced from PubChem (CID 115410289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).