2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide

C10H13NO4 — CID 964386

IUPAC2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide
SMILESCOc1cccc(CO)c1OCC(N)=O
InChIInChI=1S/C10H13NO4/c1-14-8-4-2-3-7(5-12)10(8)15-6-9(11)13/h2-4,12H,5-6H2,1H3,(H2,11,13)
InChIKeyXUVRGVVNVIPVNA-UHFFFAOYSA-N
MW211.22 g/mol
LogP0.05
Rot. Bonds5

About 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide

2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide (PubChem CID 964386) has the molecular formula C10H13NO4 and a molecular weight of 211.22 g/mol. Its IUPAC name is 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide.

Molecular Properties

Compound Name2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide
PubChem CID964386
Molecular FormulaC10H13NO4
Molecular Weight211.22 g/mol
Exact Mass211.08
IUPAC Name2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide
SMILESCOc1cccc(CO)c1OCC(N)=O
InChIInChI=1S/C10H13NO4/c1-14-8-4-2-3-7(5-12)10(8)15-6-9(11)13/h2-4,12H,5-6H2,1H3,(H2,11,13)
InChIKeyXUVRGVVNVIPVNA-UHFFFAOYSA-N
XLogP0.05
TPSA81.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-aminopropyl)-6-methoxyphenoxy]acetamide
CID 54929037
2-[2-(hydroxymethyl)-6-methoxyphenoxy]-N-(4-methylphenyl)acetamide
CID 45371710
2-[2-[(cyclooctylamino)methyl]-6-methoxyphenoxy]acetamide;hydrochloride
CID 17053366
3-[2-(hydroxymethyl)-6-methoxyphenoxy]-2,2-dimethylpropanoic acid
CID 79623918
[2-(hydroxymethyl)-6-methoxyphenyl] dihydrogen phosphate
CID 23585992
[2-(2,2-difluoroethoxy)-3-methoxyphenyl]methanol
CID 60922673
[3-methoxy-2-(pyridin-2-ylmethoxy)phenyl]methanol
CID 43471608
[2-[2-(dimethylamino)ethoxy]-3-methoxyphenyl]methanol
CID 43471611
(3-methoxy-2-nonoxyphenyl)methanol
CID 43471510
[2-(cyclopropylmethoxy)-3-methoxyphenyl]methanol
CID 43560490
2-[2-(aminomethyl)-6-methoxyphenoxy]-N,N-dimethylacetamide
CID 43471479
3-[[2-(hydroxymethyl)-6-methoxyphenoxy]methyl]pentan-3-ol
CID 114494393

Frequently Asked Questions

What is the IUPAC name of 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide?
The IUPAC name of 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide (CID 964386) is 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide.
What is the SMILES notation for 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide?
The canonical SMILES for 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide is COc1cccc(CO)c1OCC(N)=O.
What is the InChIKey of 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide?
The InChIKey is XUVRGVVNVIPVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO4/c1-14-8-4-2-3-7(5-12)10(8)15-6-9(11)13/h2-4,12H,5-6H2,1H3,(H2,11,13).
What are the key properties of 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide?
2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide has a molecular weight of 211.22 g/mol, XLogP of 0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide is sourced from PubChem (CID 964386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).