(1R,2R)-1-N,1-N-dimethylcyclopentane-1,2-diamine

• ChemBase ID: 310143
• Molecular Formular: C7H16N2
• Molecular Mass: 128.21534
• Monoisotopic Mass: 128.13134852
• SMILES: [C@H]1(N(C)C)[C@H](N)CCC1
• Canonical SMILES: CN([C@@H]1CCC[C@H]1N)C
• InChI: InChI=1S/C7H16N2/c1-9(2)7-5-3-4-6(7)8/h6-7H,3-5,8H2,1-2H3/t6-,7-/m1/s1
• InChIKey: VCJNAZAMCYBDCP-RNFRBKRXSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (1R,2R)-1-N,1-N-dimethylcyclopentane-1,2-diamine
• IUPAC Traditional name: (1R,2R)-1-N,1-N-dimethylcyclopentane-1,2-diamine
• Synonyms: rac-(1R,2R)-N,N-dimethyl-1,2-cyclopentanediamine

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -4.731241
• LogD (pH = 7.4): -2.4636266
• Log P: 0.36308593
• Molar Refractivity: 39.4203 cm^3
• Polarizability: 15.965017 Å^3
• Polar Surface Area: 29.26 Å^2