3-hydroxy-N-methoxy-N-methylpropanamide

C5H11NO3 — CID 23226612

IUPAC3-hydroxy-N-methoxy-N-methylpropanamide
SMILESCON(C)C(=O)CCO
InChIInChI=1S/C5H11NO3/c1-6(9-2)5(8)3-4-7/h7H,3-4H2,1-2H3
InChIKeyJZCZEQVFNHECND-UHFFFAOYSA-N
MW133.15 g/mol
LogP-0.61
Rot. Bonds3

About 3-hydroxy-N-methoxy-N-methylpropanamide

3-hydroxy-N-methoxy-N-methylpropanamide (PubChem CID 23226612) has the molecular formula C5H11NO3 and a molecular weight of 133.15 g/mol. Its IUPAC name is 3-hydroxy-N-methoxy-N-methylpropanamide.

Molecular Properties

Compound Name3-hydroxy-N-methoxy-N-methylpropanamide
PubChem CID23226612
Molecular FormulaC5H11NO3
Molecular Weight133.15 g/mol
Exact Mass133.07
IUPAC Name3-hydroxy-N-methoxy-N-methylpropanamide
SMILESCON(C)C(=O)CCO
InChIInChI=1S/C5H11NO3/c1-6(9-2)5(8)3-4-7/h7H,3-4H2,1-2H3
InChIKeyJZCZEQVFNHECND-UHFFFAOYSA-N
XLogP-0.61
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 3-hydroxy-N-methoxy-N-methylpropanamide?
The IUPAC name of 3-hydroxy-N-methoxy-N-methylpropanamide (CID 23226612) is 3-hydroxy-N-methoxy-N-methylpropanamide.
What is the SMILES notation for 3-hydroxy-N-methoxy-N-methylpropanamide?
The canonical SMILES for 3-hydroxy-N-methoxy-N-methylpropanamide is CON(C)C(=O)CCO.
What is the InChIKey of 3-hydroxy-N-methoxy-N-methylpropanamide?
The InChIKey is JZCZEQVFNHECND-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO3/c1-6(9-2)5(8)3-4-7/h7H,3-4H2,1-2H3.
What are the key properties of 3-hydroxy-N-methoxy-N-methylpropanamide?
3-hydroxy-N-methoxy-N-methylpropanamide has a molecular weight of 133.15 g/mol, XLogP of -0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-methoxy-N-methylpropanamide is sourced from PubChem (CID 23226612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).