methyl({4-[2-(morpholin-4-yl)ethoxy]phenyl}methyl)amine

• ChemBase ID: 88962
• Molecular Formular: C14H22N2O2
• Molecular Mass: 250.33668
• Monoisotopic Mass: 250.16812795
• SMILES: N(C)Cc1ccc(cc1)OCCN1CCOCC1
• Canonical SMILES: CNCc1ccc(cc1)OCCN1CCOCC1
• InChI: InChI=1S/C14H22N2O2/c1-15-12-13-2-4-14(5-3-13)18-11-8-16-6-9-17-10-7-16/h2-5,15H,6-12H2,1H3
• InChIKey: CFDWJPMGCABITD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyl({4-[2-(morpholin-4-yl)ethoxy]phenyl}methyl)amine
• IUPAC Traditional name: methyl({4-[2-(morpholin-4-yl)ethoxy]phenyl}methyl)amine
• Synonyms: N-methyl-N-[4-(2-morpholin-4-ylethoxy)benzyl]amine; N-Methyl-N-4-(2-morpholin-4-ylethoxy)benzylamine 95%

Database IDs

• CAS Number: 852180-77-9
• MDL Number: MFCD07368554
• PubChem SID: 162075848
• PubChem CID: 7060587

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): -3.199284
• LogD (pH = 7.4): -1.0575769
• Log P: 1.1740675
• Molar Refractivity: 72.8628 cm^3
• Polarizability: 28.751495 Å^3
• Polar Surface Area: 33.73 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Corrosive

Product Information

• Purity: 95%