2,2,6,6-tetramethyl(1-15N)piperidin-4-amine

• ChemBase ID: 160493
• Molecular Formular: C9H20N2
• Molecular Mass: 157.2619089
• Monoisotopic Mass: 157.15968354
• SMILES: C1(CC([15NH]C(C1)(C)C)(C)C)N
• Canonical SMILES: NC1CC(C)(C)[15NH]C(C1)(C)C
• InChI: InChI=1S/C9H20N2/c1-8(2)5-7(10)6-9(3,4)11-8/h7,11H,5-6,10H2,1-4H3/i11+1
• InChIKey: FTVFPPFZRRKJIH-KHWBWMQUSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,2,6,6-tetramethyl(1-^1^5N)piperidin-4-amine
• IUPAC Traditional name: 2,2,6,6-tetramethyl(1-^1^5N)piperidin-4-amine
• Synonyms: 4-Amino-2,2,6,6-tetramethylpiperidine-1-15N

Database IDs

• CAS Number: 1215537-22-6
• PubChem SID: 162254628
• PubChem CID: 46780359

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -5.373344
• LogD (pH = 7.4): -3.4947853
• Log P: 0.41260272
• Molar Refractivity: 48.1892 cm^3
• Polarizability: 19.657892 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Dichloromethane; Ethyl Acetate; Methanol
• Apperance: Pale Yellow Oil