6-(2,4-difluorophenyl)pyridine-2,3-diamine

C11H9F2N3 — CID 23154179

IUPAC6-(2,4-difluorophenyl)pyridine-2,3-diamine
SMILESNc1ccc(-c2ccc(F)cc2F)nc1N
InChIInChI=1S/C11H9F2N3/c12-6-1-2-7(8(13)5-6)10-4-3-9(14)11(15)16-10/h1-5H,14H2,(H2,15,16)
InChIKeyUSGKXDSMLGAMTN-UHFFFAOYSA-N
MW221.21 g/mol
LogP2.19
Rot. Bonds1

About 6-(2,4-difluorophenyl)pyridine-2,3-diamine

6-(2,4-difluorophenyl)pyridine-2,3-diamine (PubChem CID 23154179) has the molecular formula C11H9F2N3 and a molecular weight of 221.21 g/mol. Its IUPAC name is 6-(2,4-difluorophenyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-(2,4-difluorophenyl)pyridine-2,3-diamine
PubChem CID23154179
Molecular FormulaC11H9F2N3
Molecular Weight221.21 g/mol
Exact Mass221.08
IUPAC Name6-(2,4-difluorophenyl)pyridine-2,3-diamine
SMILESNc1ccc(-c2ccc(F)cc2F)nc1N
InChIInChI=1S/C11H9F2N3/c12-6-1-2-7(8(13)5-6)10-4-3-9(14)11(15)16-10/h1-5H,14H2,(H2,15,16)
InChIKeyUSGKXDSMLGAMTN-UHFFFAOYSA-N
XLogP2.19
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.21
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-difluorophenyl)pyridine-2,3-diamine?
The IUPAC name of 6-(2,4-difluorophenyl)pyridine-2,3-diamine (CID 23154179) is 6-(2,4-difluorophenyl)pyridine-2,3-diamine.
What is the SMILES notation for 6-(2,4-difluorophenyl)pyridine-2,3-diamine?
The canonical SMILES for 6-(2,4-difluorophenyl)pyridine-2,3-diamine is Nc1ccc(-c2ccc(F)cc2F)nc1N.
What is the InChIKey of 6-(2,4-difluorophenyl)pyridine-2,3-diamine?
The InChIKey is USGKXDSMLGAMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F2N3/c12-6-1-2-7(8(13)5-6)10-4-3-9(14)11(15)16-10/h1-5H,14H2,(H2,15,16).
What are the key properties of 6-(2,4-difluorophenyl)pyridine-2,3-diamine?
6-(2,4-difluorophenyl)pyridine-2,3-diamine has a molecular weight of 221.21 g/mol, XLogP of 2.19, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-difluorophenyl)pyridine-2,3-diamine is sourced from PubChem (CID 23154179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).