dimethyl[3-(piperidin-4-yloxy)propyl]amine

• ChemBase ID: 286645
• Molecular Formular: C10H22N2O
• Molecular Mass: 186.29448
• Monoisotopic Mass: 186.17321333
• SMILES: N1CCC(CC1)OCCCN(C)C
• Canonical SMILES: CN(CCCOC1CCNCC1)C
• InChI: InChI=1S/C10H22N2O/c1-12(2)8-3-9-13-10-4-6-11-7-5-10/h10-11H,3-9H2,1-2H3
• InChIKey: HYBWJSXMJVVCOE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dimethyl[3-(piperidin-4-yloxy)propyl]amine
• IUPAC Traditional name: dimethyl[3-(piperidin-4-yloxy)propyl]amine
• Synonyms: dimethyl[3-(piperidin-4-yloxy)propyl]amine

Database IDs

• MDL Number: MFCD06247271
• PubChem SID: 180672176
• PubChem CID: 61103075

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -6.7441688
• LogD (pH = 7.4): -4.7305264
• Log P: -0.15308811
• Molar Refractivity: 56.0534 cm^3
• Polarizability: 22.168617 Å^3
• Polar Surface Area: 24.5 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.115

Product Information

• Purity: 95%