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

C7H5F5N2 — CID 130094791

IUPAC6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine
SMILESNc1ccc(C(F)F)nc1C(F)(F)F
InChIInChI=1S/C7H5F5N2/c8-6(9)4-2-1-3(13)5(14-4)7(10,11)12/h1-2,6H,13H2
InChIKeyMHGOVZNQQFWROL-UHFFFAOYSA-N
MW212.12 g/mol
LogP2.62
Rot. Bonds1

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

6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine (PubChem CID 130094791) has the molecular formula C7H5F5N2 and a molecular weight of 212.12 g/mol. Its IUPAC name is 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine
PubChem CID130094791
Molecular FormulaC7H5F5N2
Molecular Weight212.12 g/mol
Exact Mass212.04
IUPAC Name6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine
SMILESNc1ccc(C(F)F)nc1C(F)(F)F
InChIInChI=1S/C7H5F5N2/c8-6(9)4-2-1-3(13)5(14-4)7(10,11)12/h1-2,6H,13H2
InChIKeyMHGOVZNQQFWROL-UHFFFAOYSA-N
XLogP2.62
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.12
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine (CID 130094791) is 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine is Nc1ccc(C(F)F)nc1C(F)(F)F.
What is the InChIKey of 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine?
The InChIKey is MHGOVZNQQFWROL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F5N2/c8-6(9)4-2-1-3(13)5(14-4)7(10,11)12/h1-2,6H,13H2.
What are the key properties of 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine?
6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine has a molecular weight of 212.12 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 130094791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).