2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine

C8H7F5N2 — CID 118828414

IUPAC2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine
SMILESCc1cc(N)c(C(F)(F)F)c(C(F)F)n1
InChIInChI=1S/C8H7F5N2/c1-3-2-4(14)5(8(11,12)13)6(15-3)7(9)10/h2,7H,1H3,(H2,14,15)
InChIKeyLBIRKESPMACRAR-UHFFFAOYSA-N
MW226.15 g/mol
LogP2.93
Rot. Bonds1

About 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine

2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine (PubChem CID 118828414) has the molecular formula C8H7F5N2 and a molecular weight of 226.15 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine
PubChem CID118828414
Molecular FormulaC8H7F5N2
Molecular Weight226.15 g/mol
Exact Mass226.05
IUPAC Name2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine
SMILESCc1cc(N)c(C(F)(F)F)c(C(F)F)n1
InChIInChI=1S/C8H7F5N2/c1-3-2-4(14)5(8(11,12)13)6(15-3)7(9)10/h2,7H,1H3,(H2,14,15)
InChIKeyLBIRKESPMACRAR-UHFFFAOYSA-N
XLogP2.93
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.15
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine?
The IUPAC name of 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine (CID 118828414) is 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine.
What is the SMILES notation for 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine?
The canonical SMILES for 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine is Cc1cc(N)c(C(F)(F)F)c(C(F)F)n1.
What is the InChIKey of 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine?
The InChIKey is LBIRKESPMACRAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F5N2/c1-3-2-4(14)5(8(11,12)13)6(15-3)7(9)10/h2,7H,1H3,(H2,14,15).
What are the key properties of 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine?
2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine has a molecular weight of 226.15 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6-methyl-3-(trifluoromethyl)pyridin-4-amine is sourced from PubChem (CID 118828414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).