[2-(morpholin-4-yl)cyclopentyl]methanamine

• ChemBase ID: 270522
• Molecular Formular: C10H20N2O
• Molecular Mass: 184.2786
• Monoisotopic Mass: 184.15756327
• SMILES: N1(C2C(CN)CCC2)CCOCC1
• Canonical SMILES: NCC1CCCC1N1CCOCC1
• InChI: InChI=1S/C10H20N2O/c11-8-9-2-1-3-10(9)12-4-6-13-7-5-12/h9-10H,1-8,11H2
• InChIKey: DDIJIFBJNGYVQA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [2-(morpholin-4-yl)cyclopentyl]methanamine
• IUPAC Traditional name: [2-(morpholin-4-yl)cyclopentyl]methanamine
• Synonyms: [2-(morpholin-4-yl)cyclopentyl]methanamine

Database IDs

• MDL Number: MFCD11632789
• PubChem SID: 164326432
• PubChem CID: 43293330

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -4.786064
• LogD (pH = 7.4): -2.732255
• Log P: 0.18934003
• Molar Refractivity: 53.4348 cm^3
• Polarizability: 21.43625 Å^3
• Polar Surface Area: 38.49 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.181

Product Information

• Purity: 95%