2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide

C12H16N2O4 — CID 112550753

IUPAC2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide
SMILESCc1cccc(C)c1OCC(=O)NOCC(N)=O
InChIInChI=1S/C12H16N2O4/c1-8-4-3-5-9(2)12(8)17-7-11(16)14-18-6-10(13)15/h3-5H,6-7H2,1-2H3,(H2,13,15)(H,14,16)
InChIKeyGZLWNHMXYNZLFI-UHFFFAOYSA-N
MW252.27 g/mol
LogP0.22
Rot. Bonds6

About 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide

2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide (PubChem CID 112550753) has the molecular formula C12H16N2O4 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide.

Molecular Properties

Compound Name2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide
PubChem CID112550753
Molecular FormulaC12H16N2O4
Molecular Weight252.27 g/mol
Exact Mass252.11
IUPAC Name2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide
SMILESCc1cccc(C)c1OCC(=O)NOCC(N)=O
InChIInChI=1S/C12H16N2O4/c1-8-4-3-5-9(2)12(8)17-7-11(16)14-18-6-10(13)15/h3-5H,6-7H2,1-2H3,(H2,13,15)(H,14,16)
InChIKeyGZLWNHMXYNZLFI-UHFFFAOYSA-N
XLogP0.22
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 50.22
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-(2,6-dimethylphenoxy)-N'-methylacetohydrazide
CID 116820679
2-(2,6-dimethylphenoxy)-N-[1,1,2,2-tetradeuterio-2-[[2-(2,6-dimethylphenoxy)acetyl]amino]ethyl]acetamide
CID 171381792
methyl (2R)-2-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-methylbutanoate
CID 40938621
2-(2,6-dimethylphenoxy)-N-[6-[[2-(2,6-dimethylphenoxy)acetyl]amino]hexyl]acetamide
CID 3463804
N-(2-amino-6-methylphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 43376385
N'-[2-(2,6-dimethylphenoxy)acetyl]-2-phenylacetohydrazide
CID 4503699
2-(2,6-dimethylphenoxy)-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]acetamide
CID 79247450
N-(4-aminobutyl)-2-(2,6-dimethylphenoxy)acetamide
CID 82335715
2-(2,6-dimethylphenoxy)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
CID 103716567
2-(4-chloro-2,6-dimethylphenoxy)-N-phenylmethoxyacetamide
CID 9227392
N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]propanamide
CID 4506058
benzyl N-[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamate
CID 4935787

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide?
The IUPAC name of 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide (CID 112550753) is 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide.
What is the SMILES notation for 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide?
The canonical SMILES for 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide is Cc1cccc(C)c1OCC(=O)NOCC(N)=O.
What is the InChIKey of 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide?
The InChIKey is GZLWNHMXYNZLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O4/c1-8-4-3-5-9(2)12(8)17-7-11(16)14-18-6-10(13)15/h3-5H,6-7H2,1-2H3,(H2,13,15)(H,14,16).
What are the key properties of 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide?
2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide has a molecular weight of 252.27 g/mol, XLogP of 0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2,6-dimethylphenoxy)acetyl]amino]oxyacetamide is sourced from PubChem (CID 112550753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).