5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine

C11H6ClF3N2 — CID 79727964

IUPAC5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine
SMILESFc1cc(Cl)cnc1Nc1c(F)cccc1F
InChIInChI=1S/C11H6ClF3N2/c12-6-4-9(15)11(16-5-6)17-10-7(13)2-1-3-8(10)14/h1-5H,(H,16,17)
InChIKeyZZXCQTFKQGJXFQ-UHFFFAOYSA-N
MW258.63 g/mol
LogP3.90
Rot. Bonds2

About 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine

5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine (PubChem CID 79727964) has the molecular formula C11H6ClF3N2 and a molecular weight of 258.63 g/mol. Its IUPAC name is 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine
PubChem CID79727964
Molecular FormulaC11H6ClF3N2
Molecular Weight258.63 g/mol
Exact Mass258.02
IUPAC Name5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine
SMILESFc1cc(Cl)cnc1Nc1c(F)cccc1F
InChIInChI=1S/C11H6ClF3N2/c12-6-4-9(15)11(16-5-6)17-10-7(13)2-1-3-8(10)14/h1-5H,(H,16,17)
InChIKeyZZXCQTFKQGJXFQ-UHFFFAOYSA-N
XLogP3.90
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.63
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-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 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine?
The IUPAC name of 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine (CID 79727964) is 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine.
What is the SMILES notation for 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine?
The canonical SMILES for 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine is Fc1cc(Cl)cnc1Nc1c(F)cccc1F.
What is the InChIKey of 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine?
The InChIKey is ZZXCQTFKQGJXFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF3N2/c12-6-4-9(15)11(16-5-6)17-10-7(13)2-1-3-8(10)14/h1-5H,(H,16,17).
What are the key properties of 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine?
5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine has a molecular weight of 258.63 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,6-difluorophenyl)-3-fluoropyridin-2-amine is sourced from PubChem (CID 79727964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).