(2-amino-4-methylpentyl)dimethylamine

• ChemBase ID: 258570
• Molecular Formular: C8H20N2
• Molecular Mass: 144.2578
• Monoisotopic Mass: 144.16264865
• SMILES: N(CC(N)CC(C)C)(C)C
• Canonical SMILES: CC(CC(CN(C)C)N)C
• InChI: InChI=1S/C8H20N2/c1-7(2)5-8(9)6-10(3)4/h7-8H,5-6,9H2,1-4H3
• InChIKey: SYGGWSCXCCJJFT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-amino-4-methylpentyl)dimethylamine
• IUPAC Traditional name: (2-amino-4-methylpentyl)dimethylamine
• Synonyms: (2-amino-4-methylpentyl)dimethylamine

Database IDs

• MDL Number: MFCD11155326
• PubChem SID: 164314480
• PubChem CID: 20383004

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.6934204
• LogD (pH = 7.4): -1.4665205
• Log P: 1.0638708
• Molar Refractivity: 46.0303 cm^3
• Polarizability: 18.552586 Å^3
• Polar Surface Area: 29.26 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.443

Product Information

• Purity: 95%