(furan-2-ylmethyl)[2-(morpholin-4-yl)ethyl]amine

• ChemBase ID: 312223
• Molecular Formular: C11H18N2O2
• Molecular Mass: 210.27282
• Monoisotopic Mass: 210.13682783
• SMILES: N1(CCNCc2occc2)CCOCC1
• Canonical SMILES: O1CCN(CC1)CCNCc1ccco1
• InChI: InChI=1S/C11H18N2O2/c1-2-11(15-7-1)10-12-3-4-13-5-8-14-9-6-13/h1-2,7,12H,3-6,8-10H2
• InChIKey: XODQIXKMHPJBFF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (furan-2-ylmethyl)[2-(morpholin-4-yl)ethyl]amine
• IUPAC Traditional name: (furan-2-ylmethyl)[2-(morpholin-4-yl)ethyl]amine
• Synonyms: (2-furylmethyl)(2-morpholin-4-ylethyl)amine

Database IDs

• CAS Number: 880813-53-6
• MDL Number: MFCD07410488

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -2.155852
• LogD (pH = 7.4): -0.40331215
• Log P: 0.39198536
• Molar Refractivity: 58.7905 cm^3
• Polarizability: 23.096922 Å^3
• Polar Surface Area: 37.64 Å^2