2,6-dimethyl-4-(piperidin-4-yl)morpholine

• ChemBase ID: 265056
• Molecular Formular: C11H22N2O
• Molecular Mass: 198.30518
• Monoisotopic Mass: 198.17321333
• SMILES: N1(CC(OC(C1)C)C)C1CCNCC1
• Canonical SMILES: CC1OC(C)CN(C1)C1CCNCC1
• InChI: InChI=1S/C11H22N2O/c1-9-7-13(8-10(2)14-9)11-3-5-12-6-4-11/h9-12H,3-8H2,1-2H3
• InChIKey: MYYJFAYHVMWIDI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,6-dimethyl-4-(piperidin-4-yl)morpholine
• IUPAC Traditional name: 2,6-dimethyl-4-(piperidin-4-yl)morpholine
• Synonyms: 2,6-dimethyl-4-(piperidin-4-yl)morpholine

Database IDs

• MDL Number: MFCD03274732
• PubChem SID: 164320966
• PubChem CID: 3151125

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -4.3171196
• LogD (pH = 7.4): -2.4076598
• Log P: 0.44857726
• Molar Refractivity: 58.0566 cm^3
• Polarizability: 23.27968 Å^3
• Polar Surface Area: 24.5 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.608

Product Information

• Purity: 95%