N-cyano-2-(2-ethoxyphenoxy)acetamide

C11H12N2O3 — CID 79194263

IUPACN-cyano-2-(2-ethoxyphenoxy)acetamide
SMILESCCOc1ccccc1OCC(=O)NC#N
InChIInChI=1S/C11H12N2O3/c1-2-15-9-5-3-4-6-10(9)16-7-11(14)13-8-12/h3-6H,2,7H2,1H3,(H,13,14)
InChIKeyADTRRAZHIABHLG-UHFFFAOYSA-N
MW220.23 g/mol
LogP1.06
Rot. Bonds5

About N-cyano-2-(2-ethoxyphenoxy)acetamide

N-cyano-2-(2-ethoxyphenoxy)acetamide (PubChem CID 79194263) has the molecular formula C11H12N2O3 and a molecular weight of 220.23 g/mol. Its IUPAC name is N-cyano-2-(2-ethoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-cyano-2-(2-ethoxyphenoxy)acetamide
PubChem CID79194263
Molecular FormulaC11H12N2O3
Molecular Weight220.23 g/mol
Exact Mass220.08
IUPAC NameN-cyano-2-(2-ethoxyphenoxy)acetamide
SMILESCCOc1ccccc1OCC(=O)NC#N
InChIInChI=1S/C11H12N2O3/c1-2-15-9-5-3-4-6-10(9)16-7-11(14)13-8-12/h3-6H,2,7H2,1H3,(H,13,14)
InChIKeyADTRRAZHIABHLG-UHFFFAOYSA-N
XLogP1.06
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}

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Related Compounds

2-[2-(cyanoamino)-2-oxoethoxy]benzamide
CID 79194967
2-cyano-N-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]ethyl]acetamide
CID 108537298
2-(2-ethoxyphenoxy)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82726093
N'-[2-(2-ethoxyphenoxy)acetyl]-2-ethylbutanehydrazide
CID 78775327
N-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]ethyl]butanamide
CID 108572434
N-[(E)-(4-cyanophenyl)methylideneamino]-2-(2-ethoxyphenoxy)acetamide
CID 42991602
2-(2-ethoxyphenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 731794
N'-[2-(2-ethoxyphenoxy)acetyl]-2-(4-fluorophenyl)acetohydrazide
CID 26656633
2-(2-ethoxyphenoxy)-N-pyridin-4-ylacetamide
CID 78802593
ethyl N-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]ethyl]carbamate
CID 108572439
N-cyclohexyl-2-(2-ethoxyphenoxy)acetamide
CID 731871
N-(2-ethoxyphenyl)-2-(2-methoxyphenoxy)acetamide
CID 3891399

Frequently Asked Questions

What is the IUPAC name of N-cyano-2-(2-ethoxyphenoxy)acetamide?
The IUPAC name of N-cyano-2-(2-ethoxyphenoxy)acetamide (CID 79194263) is N-cyano-2-(2-ethoxyphenoxy)acetamide.
What is the SMILES notation for N-cyano-2-(2-ethoxyphenoxy)acetamide?
The canonical SMILES for N-cyano-2-(2-ethoxyphenoxy)acetamide is CCOc1ccccc1OCC(=O)NC#N.
What is the InChIKey of N-cyano-2-(2-ethoxyphenoxy)acetamide?
The InChIKey is ADTRRAZHIABHLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3/c1-2-15-9-5-3-4-6-10(9)16-7-11(14)13-8-12/h3-6H,2,7H2,1H3,(H,13,14).
What are the key properties of N-cyano-2-(2-ethoxyphenoxy)acetamide?
N-cyano-2-(2-ethoxyphenoxy)acetamide has a molecular weight of 220.23 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyano-2-(2-ethoxyphenoxy)acetamide is sourced from PubChem (CID 79194263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).