N-ethoxyacetamide

C4H9NO2 — CID 13085350

IUPACN-ethoxyacetamide
SMILESCCONC(C)=O
InChIInChI=1S/C4H9NO2/c1-3-7-5-4(2)6/h3H2,1-2H3,(H,5,6)
InChIKeyMFSUKOCGNJOMDD-UHFFFAOYSA-N
MW103.12 g/mol
LogP0.07
Rot. Bonds2

About N-ethoxyacetamide

N-ethoxyacetamide (PubChem CID 13085350) has the molecular formula C4H9NO2 and a molecular weight of 103.12 g/mol. Its IUPAC name is N-ethoxyacetamide.

Molecular Properties

Compound NameN-ethoxyacetamide
PubChem CID13085350
Molecular FormulaC4H9NO2
Molecular Weight103.12 g/mol
Exact Mass103.06
IUPAC NameN-ethoxyacetamide
SMILESCCONC(C)=O
InChIInChI=1S/C4H9NO2/c1-3-7-5-4(2)6/h3H2,1-2H3,(H,5,6)
InChIKeyMFSUKOCGNJOMDD-UHFFFAOYSA-N
XLogP0.07
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.12
LogP ≤ 50.07
H-Bond Donors ≤ 51
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-ethoxyacetamide?
The IUPAC name of N-ethoxyacetamide (CID 13085350) is N-ethoxyacetamide.
What is the SMILES notation for N-ethoxyacetamide?
The canonical SMILES for N-ethoxyacetamide is CCONC(C)=O.
What is the InChIKey of N-ethoxyacetamide?
The InChIKey is MFSUKOCGNJOMDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2/c1-3-7-5-4(2)6/h3H2,1-2H3,(H,5,6).
What are the key properties of N-ethoxyacetamide?
N-ethoxyacetamide has a molecular weight of 103.12 g/mol, XLogP of 0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxyacetamide is sourced from PubChem (CID 13085350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).