3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide

C9H18N2O4 — CID 86011575

IUPAC3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide
SMILESCOCCNC(=O)C(C)(O)CNC(C)=O
InChIInChI=1S/C9H18N2O4/c1-7(12)11-6-9(2,14)8(13)10-4-5-15-3/h14H,4-6H2,1-3H3,(H,10,13)(H,11,12)
InChIKeyUBEDOGBITODMIU-UHFFFAOYSA-N
MW218.25 g/mol
LogP-1.36
Rot. Bonds6

About 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide

3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide (PubChem CID 86011575) has the molecular formula C9H18N2O4 and a molecular weight of 218.25 g/mol. Its IUPAC name is 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide.

Molecular Properties

Compound Name3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide
PubChem CID86011575
Molecular FormulaC9H18N2O4
Molecular Weight218.25 g/mol
Exact Mass218.13
IUPAC Name3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide
SMILESCOCCNC(=O)C(C)(O)CNC(C)=O
InChIInChI=1S/C9H18N2O4/c1-7(12)11-6-9(2,14)8(13)10-4-5-15-3/h14H,4-6H2,1-3H3,(H,10,13)(H,11,12)
InChIKeyUBEDOGBITODMIU-UHFFFAOYSA-N
XLogP-1.36
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 5-1.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide?
The IUPAC name of 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide (CID 86011575) is 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide.
What is the SMILES notation for 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide?
The canonical SMILES for 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide is COCCNC(=O)C(C)(O)CNC(C)=O.
What is the InChIKey of 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide?
The InChIKey is UBEDOGBITODMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O4/c1-7(12)11-6-9(2,14)8(13)10-4-5-15-3/h14H,4-6H2,1-3H3,(H,10,13)(H,11,12).
What are the key properties of 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide?
3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide has a molecular weight of 218.25 g/mol, XLogP of -1.36, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-2-hydroxy-N-(2-methoxyethyl)-2-methylpropanamide is sourced from PubChem (CID 86011575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).