N-methyl-N-[2-(methylamino)ethyl]acetamide

• ChemBase ID: 238609
• Molecular Formular: C6H14N2O
• Molecular Mass: 130.18816
• Monoisotopic Mass: 130.11061308
• SMILES: C(=O)(N(CCNC)C)C
• Canonical SMILES: CNCCN(C(=O)C)C
• InChI: InChI=1S/C6H14N2O/c1-6(9)8(3)5-4-7-2/h7H,4-5H2,1-3H3
• InChIKey: BIIYBVAGTLBMCQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-methyl-N-[2-(methylamino)ethyl]acetamide
• IUPAC Traditional name: N-methyl-N-[2-(methylamino)ethyl]acetamide
• Synonyms: N-methyl-N-[2-(methylamino)ethyl]acetamide

Database IDs

• MDL Number: MFCD19645964
• PubChem SID: 164294519
• PubChem CID: 20571515

CALCULATED PROPERTIES

• Rotatable Bonds: 3
• Lipinski's Rule of Five: true
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -4.128191
• LogD (pH = 7.4): -3.0776536
• Log P: -0.9473396
• Molar Refractivity: 36.9837 cm^3
• Polarizability: 14.517068 Å^3
• Polar Surface Area: 32.34 Å^2

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.626

Product Information

• Purity: 95%