6-(morpholin-4-ylmethyl)pyridin-2-amine

• ChemBase ID: 245587
• Molecular Formular: C10H15N3O
• Molecular Mass: 193.2456
• Monoisotopic Mass: 193.12151212
• SMILES: n1c(N)cccc1CN1CCOCC1
• Canonical SMILES: Nc1cccc(n1)CN1CCOCC1
• InChI: InChI=1S/C10H15N3O/c11-10-3-1-2-9(12-10)8-13-4-6-14-7-5-13/h1-3H,4-8H2,(H2,11,12)
• InChIKey: SJLNIHJGRQJZAJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-(morpholin-4-ylmethyl)pyridin-2-amine
• IUPAC Traditional name: 6-(morpholin-4-ylmethyl)pyridin-2-amine
• Synonyms: 6-(morpholin-4-ylmethyl)pyridin-2-amine

Database IDs

• MDL Number: MFCD15147060
• PubChem SID: 164301497
• PubChem CID: 12077809

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): -0.398812
• LogD (pH = 7.4): 0.30311823
• Log P: 0.32547316
• Molar Refractivity: 56.01 cm^3
• Polarizability: 21.263048 Å^3
• Polar Surface Area: 51.38 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 129 - 131°C
• Hydrophobicity(logP): 0.065

Product Information

• Purity: 95%