N,N-dimethyl-6-(morpholin-2-yl)pyridin-2-amine dihydrochloride

• ChemBase ID: 63005
• Molecular Formular: C11H19Cl2N3O
• Molecular Mass: 280.19406
• Monoisotopic Mass: 279.0905176
• SMILES: n1c(N(C)C)cccc1C1OCCNC1.Cl.Cl
• Canonical SMILES: CN(c1cccc(n1)C1OCCNC1)C.Cl.Cl
• InChI: InChI=1S/C11H17N3O.2ClH/c1-14(2)11-5-3-4-9(13-11)10-8-12-6-7-15-10;;/h3-5,10,12H,6-8H2,1-2H3;2*1H
• InChIKey: GCSLTBXLDXJVQA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,N-dimethyl-6-(morpholin-2-yl)pyridin-2-amine dihydrochloride
• IUPAC Traditional name: N,N-dimethyl-6-(morpholin-2-yl)pyridin-2-amine dihydrochloride
• Synonyms: Dimethyl-(6-morpholin-2-yl-pyridin-2-yl)-amine dihydrochloride

Database IDs

• MDL Number: MFCD21606243
• PubChem SID: 162028744
• PubChem CID: 71298966

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): -1.2309442
• LogD (pH = 7.4): 0.49522603
• Log P: 1.0913514
• Molar Refractivity: 60.1888 cm^3
• Polarizability: 23.101152 Å^3
• Polar Surface Area: 37.39 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false