N,N-dimethyl-2-(methylamino)acetamide

• ChemBase ID: 122057
• Molecular Formular: C5H12N2O
• Molecular Mass: 116.16158
• Monoisotopic Mass: 116.09496301
• SMILES: C(=O)(N(C)C)CNC
• Canonical SMILES: CNCC(=O)N(C)C
• InChI: InChI=1S/C5H12N2O/c1-6-4-5(8)7(2)3/h6H,4H2,1-3H3
• InChIKey: CAGXPPQTXUCBOY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,N-dimethyl-2-(methylamino)acetamide
• IUPAC Traditional name: N,N-dimethyl-2-(methylamino)acetamide
• Synonyms: N,N-dimethyl-2-(methylamino)acetamide; N~1~,N~1~,N~2~-trimethylglycinamide

Database IDs

• CAS Number: 1857-20-1
• MDL Number: MFCD00080937
• PubChem SID: 162216410
• PubChem CID: 2063713

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -4.0507956
• LogD (pH = 7.4): -2.4997663
• Log P: -1.0744857
• Molar Refractivity: 32.3936 cm^3
• Polarizability: 12.678941 Å^3
• Polar Surface Area: 32.34 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.834

Product Information

• Purity: 95%