3-Methyl-6-(trifluoromethyl)pyridin-2-amine

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Product Information

Molecular Formula
C7H7F3N2
Molecular Weight
176.14
Description
Applications: 3-Methyl-6-(trifluoromethyl)pyridin-2-amine is a compound use in the preparation of macrocylcic compounds in the manufacturing of pharmaceutical compounds such as factor D inhibitors.
Synonyms
3-Methyl-6-(trifluoromethyl)-2-pyridinamine
IUPAC Name
3-methyl-6-(trifluoromethyl)pyridin-2-amine
SMILES
CC1=C(N=C(C=C1)C(F)(F)F)N
InChI
InChI=1S/C7H7F3N2/c1-4-2-3-5(7(8,9)10)12-6(4)11/h2-3H,1H3,(H2,11,12)
InChI Key
SURNWXZZAOHVMI-UHFFFAOYSA-N

Computed Properties

XLogP3
1.8
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
0
Exact Mass
176.05613272 g/mol
Monoisotopic Mass
176.05613272 g/mol
Topological Polar Surface Area
38.9Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
157
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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