N-ethyl-4-hydroxy-2-oxobutanamide

C6H11NO3 — CID 173138362

IUPACN-ethyl-4-hydroxy-2-oxobutanamide
SMILESCCNC(=O)C(=O)CCO
InChIInChI=1S/C6H11NO3/c1-2-7-6(10)5(9)3-4-8/h8H,2-4H2,1H3,(H,7,10)
InChIKeyQFQZAPWIRRBOCZ-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.93
Rot. Bonds4

About N-ethyl-4-hydroxy-2-oxobutanamide

N-ethyl-4-hydroxy-2-oxobutanamide (PubChem CID 173138362) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is N-ethyl-4-hydroxy-2-oxobutanamide.

Molecular Properties

Compound NameN-ethyl-4-hydroxy-2-oxobutanamide
PubChem CID173138362
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC NameN-ethyl-4-hydroxy-2-oxobutanamide
SMILESCCNC(=O)C(=O)CCO
InChIInChI=1S/C6H11NO3/c1-2-7-6(10)5(9)3-4-8/h8H,2-4H2,1H3,(H,7,10)
InChIKeyQFQZAPWIRRBOCZ-UHFFFAOYSA-N
XLogP-0.93
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-hydroxy-2-oxobutanamide?
The IUPAC name of N-ethyl-4-hydroxy-2-oxobutanamide (CID 173138362) is N-ethyl-4-hydroxy-2-oxobutanamide.
What is the SMILES notation for N-ethyl-4-hydroxy-2-oxobutanamide?
The canonical SMILES for N-ethyl-4-hydroxy-2-oxobutanamide is CCNC(=O)C(=O)CCO.
What is the InChIKey of N-ethyl-4-hydroxy-2-oxobutanamide?
The InChIKey is QFQZAPWIRRBOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-2-7-6(10)5(9)3-4-8/h8H,2-4H2,1H3,(H,7,10).
What are the key properties of N-ethyl-4-hydroxy-2-oxobutanamide?
N-ethyl-4-hydroxy-2-oxobutanamide has a molecular weight of 145.16 g/mol, XLogP of -0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-hydroxy-2-oxobutanamide is sourced from PubChem (CID 173138362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).