2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine

C7H5F5N2O — CID 118812288

IUPAC2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine
SMILESNc1ccnc(C(F)F)c1OC(F)(F)F
InChIInChI=1S/C7H5F5N2O/c8-6(9)4-5(15-7(10,11)12)3(13)1-2-14-4/h1-2,6H,(H2,13,14)
InChIKeyQELICGCGOGYRIK-UHFFFAOYSA-N
MW228.12 g/mol
LogP2.50
Rot. Bonds2

About 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine

2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine (PubChem CID 118812288) has the molecular formula C7H5F5N2O and a molecular weight of 228.12 g/mol. Its IUPAC name is 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine
PubChem CID118812288
Molecular FormulaC7H5F5N2O
Molecular Weight228.12 g/mol
Exact Mass228.03
IUPAC Name2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine
SMILESNc1ccnc(C(F)F)c1OC(F)(F)F
InChIInChI=1S/C7H5F5N2O/c8-6(9)4-5(15-7(10,11)12)3(13)1-2-14-4/h1-2,6H,(H2,13,14)
InChIKeyQELICGCGOGYRIK-UHFFFAOYSA-N
XLogP2.50
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.12
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-iodo-3-(trifluoromethoxy)pyridin-2-amine
CID 119014421
2-(difluoromethyl)-5-nitro-3-(trifluoromethoxy)pyridin-4-amine
CID 118850927
3-bromo-2-(trifluoromethoxy)pyridin-4-amine
CID 130088966
4-(aminomethyl)-6-(difluoromethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 118801499
2-(difluoromethyl)-4-methoxy-5-methyl-3-(trifluoromethoxy)pyridine
CID 134670213
[6-(difluoromethyl)-5-fluoro-4-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 134666595
2-(difluoromethyl)-4-methoxy-3-(trifluoromethoxy)-5-(trifluoromethyl)pyridine
CID 134668342
2-(difluoromethyl)-3-iodo-4-(trifluoromethyl)pyridine
CID 130096758
4-chloro-2-(difluoromethyl)-5-methoxy-3-(trifluoromethoxy)pyridine
CID 118822429
5-(aminomethyl)-2-(difluoromethyl)-3-(trifluoromethoxy)pyridine-4-carboxylic acid
CID 134668983
2-chloro-5-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine
CID 118812417
[2-(difluoromethyl)-5-iodo-3-(trifluoromethoxy)-4-pyridinyl]methanol
CID 118815229

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine?
The IUPAC name of 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine (CID 118812288) is 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine.
What is the SMILES notation for 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine?
The canonical SMILES for 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine is Nc1ccnc(C(F)F)c1OC(F)(F)F.
What is the InChIKey of 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine?
The InChIKey is QELICGCGOGYRIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F5N2O/c8-6(9)4-5(15-7(10,11)12)3(13)1-2-14-4/h1-2,6H,(H2,13,14).
What are the key properties of 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine?
2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine has a molecular weight of 228.12 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-3-(trifluoromethoxy)pyridin-4-amine is sourced from PubChem (CID 118812288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).