6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine

C14H12F4N2 — CID 102716533

IUPAC6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(-c2cc(C)ccc2F)n1
InChIInChI=1S/C14H12F4N2/c1-8-3-4-11(15)10(5-8)12-6-9(14(16,17)18)7-13(19-2)20-12/h3-7H,1-2H3,(H,19,20)
InChIKeyADPYVKRZDLADQS-UHFFFAOYSA-N
MW284.26 g/mol
LogP4.26
Rot. Bonds2

About 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine

6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102716533) has the molecular formula C14H12F4N2 and a molecular weight of 284.26 g/mol. Its IUPAC name is 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102716533
Molecular FormulaC14H12F4N2
Molecular Weight284.26 g/mol
Exact Mass284.09
IUPAC Name6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(-c2cc(C)ccc2F)n1
InChIInChI=1S/C14H12F4N2/c1-8-3-4-11(15)10(5-8)12-6-9(14(16,17)18)7-13(19-2)20-12/h3-7H,1-2H3,(H,19,20)
InChIKeyADPYVKRZDLADQS-UHFFFAOYSA-N
XLogP4.26
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.26
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine (CID 102716533) is 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine is CNc1cc(C(F)(F)F)cc(-c2cc(C)ccc2F)n1.
What is the InChIKey of 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is ADPYVKRZDLADQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F4N2/c1-8-3-4-11(15)10(5-8)12-6-9(14(16,17)18)7-13(19-2)20-12/h3-7H,1-2H3,(H,19,20).
What are the key properties of 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 284.26 g/mol, XLogP of 4.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102716533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).