O-(1-ethylpiperidin-3-yl)hydroxylamine

• ChemBase ID: 247790
• Molecular Formular: C7H16N2O
• Molecular Mass: 144.21474
• Monoisotopic Mass: 144.12626314
• SMILES: N1(CC(ON)CCC1)CC
• Canonical SMILES: NOC1CCCN(C1)CC
• InChI: InChI=1S/C7H16N2O/c1-2-9-5-3-4-7(6-9)10-8/h7H,2-6,8H2,1H3
• InChIKey: SYZPTVNMZNHKHU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: O-(1-ethylpiperidin-3-yl)hydroxylamine
• IUPAC Traditional name: O-(1-ethylpiperidin-3-yl)hydroxylamine
• Synonyms: O-(1-ethylpiperidin-3-yl)hydroxylamine

Database IDs

• MDL Number: MFCD16038317
• PubChem SID: 164303700
• PubChem CID: 71758305

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -2.8342998
• LogD (pH = 7.4): -1.3813435
• Log P: 0.47848135
• Molar Refractivity: 42.3099 cm^3
• Polarizability: 16.638529 Å^3
• Polar Surface Area: 38.49 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.484

Product Information

• Purity: 95%