2,6-dimethyl-4-[2-(piperidin-4-yloxy)ethyl]morpholine

• ChemBase ID: 246778
• Molecular Formular: C13H26N2O2
• Molecular Mass: 242.35774
• Monoisotopic Mass: 242.19942808
• SMILES: N1(CC(OC(C1)C)C)CCOC1CCNCC1
• Canonical SMILES: CC1CN(CCOC2CCNCC2)CC(O1)C
• InChI: InChI=1S/C13H26N2O2/c1-11-9-15(10-12(2)17-11)7-8-16-13-3-5-14-6-4-13/h11-14H,3-10H2,1-2H3
• InChIKey: OEJUTPHECMERII-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,6-dimethyl-4-[2-(piperidin-4-yloxy)ethyl]morpholine
• IUPAC Traditional name: 2,6-dimethyl-4-[2-(piperidin-4-yloxy)ethyl]morpholine
• Synonyms: 2,6-dimethyl-4-[2-(piperidin-4-yloxy)ethyl]morpholine

Database IDs

• MDL Number: MFCD19199838
• PubChem SID: 164302688
• PubChem CID: 55251554

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): -4.708049
• LogD (pH = 7.4): -2.4282453
• Log P: 0.40160173
• Molar Refractivity: 69.1001 cm^3
• Polarizability: 27.65224 Å^3
• Polar Surface Area: 33.73 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.78

Product Information

• Purity: 95%