N-ethyl-N-methoxyacetamide

C5H11NO2 — CID 20687603

IUPACN-ethyl-N-methoxyacetamide
SMILESCCN(OC)C(C)=O
InChIInChI=1S/C5H11NO2/c1-4-6(8-3)5(2)7/h4H2,1-3H3
InChIKeyIVVGGUAEMHWIBY-UHFFFAOYSA-N
MW117.15 g/mol
LogP0.42
Rot. Bonds2

About N-ethyl-N-methoxyacetamide

N-ethyl-N-methoxyacetamide (PubChem CID 20687603) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is N-ethyl-N-methoxyacetamide.

Molecular Properties

Compound NameN-ethyl-N-methoxyacetamide
PubChem CID20687603
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC NameN-ethyl-N-methoxyacetamide
SMILESCCN(OC)C(C)=O
InChIInChI=1S/C5H11NO2/c1-4-6(8-3)5(2)7/h4H2,1-3H3
InChIKeyIVVGGUAEMHWIBY-UHFFFAOYSA-N
XLogP0.42
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methoxyacetamide?
The IUPAC name of N-ethyl-N-methoxyacetamide (CID 20687603) is N-ethyl-N-methoxyacetamide.
What is the SMILES notation for N-ethyl-N-methoxyacetamide?
The canonical SMILES for N-ethyl-N-methoxyacetamide is CCN(OC)C(C)=O.
What is the InChIKey of N-ethyl-N-methoxyacetamide?
The InChIKey is IVVGGUAEMHWIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2/c1-4-6(8-3)5(2)7/h4H2,1-3H3.
What are the key properties of N-ethyl-N-methoxyacetamide?
N-ethyl-N-methoxyacetamide has a molecular weight of 117.15 g/mol, XLogP of 0.42, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methoxyacetamide is sourced from PubChem (CID 20687603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).