(3R)-N,N-dimethylpyrrolidin-3-amine

• ChemBase ID: 800308
• Molecular Formular: C6H14N2
• Molecular Mass: 114.18876
• Monoisotopic Mass: 114.11569846
• SMILES: N([C@H]1CNCC1)(C)C
• Canonical SMILES: CN([C@H]1CNCC1)C
• InChI: InChI=1S/C6H14N2/c1-8(2)6-3-4-7-5-6/h6-7H,3-5H2,1-2H3/t6-/m1/s1
• InChIKey: AVAWMINJNRAQFS-ZCFIWIBFSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3R)-N,N-dimethylpyrrolidin-3-amine
• IUPAC Traditional name: (3R)-N,N-dimethylpyrrolidin-3-amine
• Synonyms: (R)-Dimethyl-pyrrolidin-3-yl-amine

Database IDs

• CAS Number: 132958-72-6

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -4.6740437
• LogD (pH = 7.4): -3.3091161
• Log P: -0.22603208
• Molar Refractivity: 35.2791 cm^3
• Polarizability: 14.118806 Å^3
• Polar Surface Area: 15.27 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%