2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine

C7H6F4N2 — CID 853684

IUPAC2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine
SMILESCN(C)c1c(F)c(F)nc(F)c1F
InChIInChI=1S/C7H6F4N2/c1-13(2)5-3(8)6(10)12-7(11)4(5)9/h1-2H3
InChIKeyUAGGKULAFQBSPP-UHFFFAOYSA-N
MW194.13 g/mol
LogP1.70
Rot. Bonds1

About 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine

2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine (PubChem CID 853684) has the molecular formula C7H6F4N2 and a molecular weight of 194.13 g/mol. Its IUPAC name is 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine.

Molecular Properties

Compound Name2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine
PubChem CID853684
Molecular FormulaC7H6F4N2
Molecular Weight194.13 g/mol
Exact Mass194.05
IUPAC Name2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine
SMILESCN(C)c1c(F)c(F)nc(F)c1F
InChIInChI=1S/C7H6F4N2/c1-13(2)5-3(8)6(10)12-7(11)4(5)9/h1-2H3
InChIKeyUAGGKULAFQBSPP-UHFFFAOYSA-N
XLogP1.70
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.13
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-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

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine?
The IUPAC name of 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine (CID 853684) is 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine.
What is the SMILES notation for 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine?
The canonical SMILES for 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine is CN(C)c1c(F)c(F)nc(F)c1F.
What is the InChIKey of 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine?
The InChIKey is UAGGKULAFQBSPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F4N2/c1-13(2)5-3(8)6(10)12-7(11)4(5)9/h1-2H3.
What are the key properties of 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine?
2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine has a molecular weight of 194.13 g/mol, XLogP of 1.70, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetrafluoro-N,N-dimethylpyridin-4-amine is sourced from PubChem (CID 853684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).