N-(2-methoxyethyl)-2-(methylamino)acetamide

• ChemBase ID: 250464
• Molecular Formular: C6H14N2O2
• Molecular Mass: 146.18756
• Monoisotopic Mass: 146.1055277
• SMILES: C(=O)(NCCOC)CNC
• Canonical SMILES: CNCC(=O)NCCOC
• InChI: InChI=1S/C6H14N2O2/c1-7-5-6(9)8-3-4-10-2/h7H,3-5H2,1-2H3,(H,8,9)
• InChIKey: IAAQYBLYYCKZOI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-(2-methoxyethyl)-2-(methylamino)acetamide
• IUPAC Traditional name: N-(2-methoxyethyl)-2-(methylamino)acetamide
• Synonyms: N-(2-methoxyethyl)-2-(methylamino)acetamide

Database IDs

• MDL Number: MFCD06658937
• PubChem SID: 164306374
• PubChem CID: 7131125

CALCULATED PROPERTIES

• Acid pKa: 15.742384
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -4.3162947
• LogD (pH = 7.4): -2.7598133
• Log P: -1.3451372
• Molar Refractivity: 38.5404 cm^3
• Polarizability: 15.233851 Å^3
• Polar Surface Area: 50.36 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.968

Product Information

• Purity: 95%