N-methyl-N-[2-(N-methylformamido)ethyl]formamide

• ChemBase ID: 111908
• Molecular Formular: C6H12N2O2
• Molecular Mass: 144.17168
• Monoisotopic Mass: 144.08987763
• SMILES: CN(CCN(C)C=O)C=O
• Canonical SMILES: O=CN(CCN(C=O)C)C
• InChI: InChI=1S/C6H12N2O2/c1-7(5-9)3-4-8(2)6-10/h5-6H,3-4H2,1-2H3
• InChIKey: VRNZHZHNUUGILQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-methyl-N-[2-(N-methylformamido)ethyl]formamide
• IUPAC Traditional name: N-methyl-N-[2-(N-methylformamido)ethyl]formamide
• Synonyms: N,N'-DIFORMYL-N,N'-DIMETHYLETHYLENE DIAMINE

Database IDs

• CAS Number: 6632-41-3
• PubChem SID: 162098107
• PubChem CID: 245579

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -1.4347956
• LogD (pH = 7.4): -1.4347948
• Log P: -1.4347948
• Molar Refractivity: 37.5686 cm^3
• Polarizability: 14.254132 Å^3
• Polar Surface Area: 40.62 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05221676

MP Biomedicals Rare Chemical collection