methyl({[1-(morpholin-4-yl)cyclohexyl]methyl})amine

• ChemBase ID: 306569
• Molecular Formular: C12H24N2O
• Molecular Mass: 212.33176
• Monoisotopic Mass: 212.1888634
• SMILES: N1(C2(CNC)CCCCC2)CCOCC1
• Canonical SMILES: CNCC1(CCCCC1)N1CCOCC1
• InChI: InChI=1S/C12H24N2O/c1-13-11-12(5-3-2-4-6-12)14-7-9-15-10-8-14/h13H,2-11H2,1H3
• InChIKey: NYEQGTYSDSKVFR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyl({[1-(morpholin-4-yl)cyclohexyl]methyl})amine
• IUPAC Traditional name: methyl({[1-(morpholin-4-yl)cyclohexyl]methyl})amine
• Synonyms: N-methyl-1-(1-morpholin-4-ylcyclohexyl)methanamine

Database IDs

• CAS Number: 938458-83-4
• MDL Number: MFCD09055188

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -2.5236802
• LogD (pH = 7.4): -1.4099805
• Log P: 1.3303049
• Molar Refractivity: 62.6908 cm^3
• Polarizability: 25.1236 Å^3
• Polar Surface Area: 24.5 Å^2