ethyl[2-(pyridin-2-yl)ethyl]amine

• ChemBase ID: 109594
• Molecular Formular: C9H14N2
• Molecular Mass: 150.22086
• Monoisotopic Mass: 150.11569846
• SMILES: CCNCCc1ccccn1
• Canonical SMILES: CCNCCc1ccccn1
• InChI: InChI=1S/C9H14N2/c1-2-10-8-6-9-5-3-4-7-11-9/h3-5,7,10H,2,6,8H2,1H3
• InChIKey: IFZVQNMIQKLTKI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: ethyl[2-(pyridin-2-yl)ethyl]amine
• IUPAC Traditional name: ethyl[2-(pyridin-2-yl)ethyl]amine
• Synonyms: 2-(β-ETHYLAMINOETHYL) PYRIDINE; ethyl[2-(pyridin-2-yl)ethyl]amine

Database IDs

• CAS Number: 6304-26-3
• MDL Number: MFCD00023542
• PubChem SID: 162095153
• PubChem CID: 80553

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.2308946
• LogD (pH = 7.4): -1.3992987
• Log P: 0.9892148
• Molar Refractivity: 46.0749 cm^3
• Polarizability: 18.266941 Å^3
• Polar Surface Area: 24.92 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.611

Product Information

• Purity: 95%

DETAILS

MP Biomedicals - 05211724

MP Biomedicals Rare Chemical collection