morpholine-4-carboxamide

• ChemBase ID: 260070
• Molecular Formular: C5H10N2O2
• Molecular Mass: 130.1451
• Monoisotopic Mass: 130.07422757
• SMILES: C(=O)(N1CCOCC1)N
• Canonical SMILES: NC(=O)N1CCOCC1
• InChI: InChI=1S/C5H10N2O2/c6-5(8)7-1-3-9-4-2-7/h1-4H2,(H2,6,8)
• InChIKey: ZKWFSTHEYLJLEL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: morpholine-4-carboxamide
• IUPAC Traditional name: morpholine-4-carboxamide
• Synonyms: morpholine-4-carboxamide

Database IDs

• MDL Number: MFCD00085717
• PubChem SID: 164315980
• PubChem CID: 75088

CALCULATED PROPERTIES

• Acid pKa: 15.790847
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -1.1349822
• LogD (pH = 7.4): -1.1349822
• Log P: -1.1349822
• Molar Refractivity: 32.0105 cm^3
• Polarizability: 12.331205 Å^3
• Polar Surface Area: 55.56 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 106 - 108°C
• Hydrophobicity(logP): -1.619

Product Information

• Purity: 95%