2-amino-N,N-diethylacetamide

• ChemBase ID: 264206
• Molecular Formular: C6H14N2O
• Molecular Mass: 130.18816
• Monoisotopic Mass: 130.11061308
• SMILES: C(=O)(N(CC)CC)CN
• Canonical SMILES: CCN(C(=O)CN)CC
• InChI: InChI=1S/C6H14N2O/c1-3-8(4-2)6(9)5-7/h3-5,7H2,1-2H3
• InChIKey: CEHVLIKQGJYEJA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-amino-N,N-diethylacetamide
• IUPAC Traditional name: 2-amino-N,N-diethylacetamide
• Synonyms: 2-amino-N,N-diethylacetamide

Database IDs

• MDL Number: MFCD08060128
• PubChem SID: 164320116
• PubChem CID: 420729

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.281386
• LogD (pH = 7.4): -1.5973041
• Log P: -0.7934501
• Molar Refractivity: 37.1162 cm^3
• Polarizability: 14.517068 Å^3
• Polar Surface Area: 46.33 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.117

Product Information

• Purity: 95%