6-(2,6-dimethylmorpholin-4-yl)pyridin-3-amine

• ChemBase ID: 258808
• Molecular Formular: C11H17N3O
• Molecular Mass: 207.27218
• Monoisotopic Mass: 207.13716218
• SMILES: N1(c2ncc(N)cc2)CC(OC(C1)C)C
• Canonical SMILES: CC1OC(C)CN(C1)c1ccc(cn1)N
• InChI: InChI=1S/C11H17N3O/c1-8-6-14(7-9(2)15-8)11-4-3-10(12)5-13-11/h3-5,8-9H,6-7,12H2,1-2H3
• InChIKey: VLPBNQMPKNGOJC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-(2,6-dimethylmorpholin-4-yl)pyridin-3-amine
• IUPAC Traditional name: 6-(2,6-dimethylmorpholin-4-yl)pyridin-3-amine
• Synonyms: 6-(2,6-dimethylmorpholin-4-yl)pyridin-3-amine

Database IDs

• MDL Number: MFCD09050759
• PubChem SID: 164314718
• PubChem CID: 16778276

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): 0.121957056
• LogD (pH = 7.4): 1.1439894
• Log P: 1.2437984
• Molar Refractivity: 61.2557 cm^3
• Polarizability: 22.721037 Å^3
• Polar Surface Area: 51.38 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.725

Product Information

• Purity: 95%