6-(dimethylamino)pyridine-2-carboximidamide

• ChemBase ID: 244111
• Molecular Formular: C8H12N4
• Molecular Mass: 164.20768
• Monoisotopic Mass: 164.1061964
• SMILES: n1c(N(C)C)cccc1C(=N)N
• Canonical SMILES: CN(c1cccc(n1)C(=N)N)C
• InChI: InChI=1S/C8H12N4/c1-12(2)7-5-3-4-6(11-7)8(9)10/h3-5H,1-2H3,(H3,9,10)
• InChIKey: RRMNUDALUGHDQT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-(dimethylamino)pyridine-2-carboximidamide
• IUPAC Traditional name: 6-(dimethylamino)pyridine-2-carboximidamide
• Synonyms: 6-(dimethylamino)pyridine-2-carboximidamide

Database IDs

• MDL Number: MFCD20367699
• PubChem SID: 164300021
• PubChem CID: 64593978

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -1.617484
• LogD (pH = 7.4): -0.7919953
• Log P: 0.76439357
• Molar Refractivity: 59.9437 cm^3
• Polarizability: 17.946993 Å^3
• Polar Surface Area: 66.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.387

Product Information

• Purity: 95%