2-amino-N-methyl-2-phenyl-N-(thiophen-3-ylmethyl)acetamide hydrochloride

• ChemBase ID: 242294
• Molecular Formular: C14H17ClN2OS
• Molecular Mass: 296.81558
• Monoisotopic Mass: 296.07501185
• SMILES: C(=O)(N(Cc1cscc1)C)C(c1ccccc1)N.Cl
• Canonical SMILES: O=C(C(c1ccccc1)N)N(Cc1cscc1)C.Cl
• InChI: InChI=1S/C14H16N2OS.ClH/c1-16(9-11-7-8-18-10-11)14(17)13(15)12-5-3-2-4-6-12;/h2-8,10,13H,9,15H2,1H3;1H
• InChIKey: FJAZKTQBIDNSQF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-amino-N-methyl-2-phenyl-N-(thiophen-3-ylmethyl)acetamide hydrochloride
• IUPAC Traditional name: 2-amino-N-methyl-2-phenyl-N-(thiophen-3-ylmethyl)acetamide hydrochloride
• Synonyms: 2-amino-N-methyl-2-phenyl-N-(thiophen-3-ylmethyl)acetamide hydrochloride

Database IDs

• MDL Number: MFCD22566020
• PubChem SID: 164298204
• PubChem CID: 71756983

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.23641847
• LogD (pH = 7.4): 1.4372114
• Log P: 1.9342785
• Molar Refractivity: 73.6953 cm^3
• Polarizability: 28.66355 Å^3
• Polar Surface Area: 46.33 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.733

Product Information

• Purity: 95%