N-ethyl-N-(2-oxoethyl)acetamide

C6H11NO2 — CID 23525604

IUPACN-ethyl-N-(2-oxoethyl)acetamide
SMILESCCN(CC=O)C(C)=O
InChIInChI=1S/C6H11NO2/c1-3-7(4-5-8)6(2)9/h5H,3-4H2,1-2H3
InChIKeyCDUWQBZLSIOAKD-UHFFFAOYSA-N
MW129.16 g/mol
LogP0.05
Rot. Bonds3

About N-ethyl-N-(2-oxoethyl)acetamide

N-ethyl-N-(2-oxoethyl)acetamide (PubChem CID 23525604) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is N-ethyl-N-(2-oxoethyl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(2-oxoethyl)acetamide
PubChem CID23525604
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC NameN-ethyl-N-(2-oxoethyl)acetamide
SMILESCCN(CC=O)C(C)=O
InChIInChI=1S/C6H11NO2/c1-3-7(4-5-8)6(2)9/h5H,3-4H2,1-2H3
InChIKeyCDUWQBZLSIOAKD-UHFFFAOYSA-N
XLogP0.05
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 50.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-oxoethyl)acetamide?
The IUPAC name of N-ethyl-N-(2-oxoethyl)acetamide (CID 23525604) is N-ethyl-N-(2-oxoethyl)acetamide.
What is the SMILES notation for N-ethyl-N-(2-oxoethyl)acetamide?
The canonical SMILES for N-ethyl-N-(2-oxoethyl)acetamide is CCN(CC=O)C(C)=O.
What is the InChIKey of N-ethyl-N-(2-oxoethyl)acetamide?
The InChIKey is CDUWQBZLSIOAKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-3-7(4-5-8)6(2)9/h5H,3-4H2,1-2H3.
What are the key properties of N-ethyl-N-(2-oxoethyl)acetamide?
N-ethyl-N-(2-oxoethyl)acetamide has a molecular weight of 129.16 g/mol, XLogP of 0.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-oxoethyl)acetamide is sourced from PubChem (CID 23525604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).