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

C11H9F2N3 — CID 80647983

IUPAC6-N-(2,4-difluorophenyl)pyridine-2,6-diamine
SMILESNc1cccc(Nc2ccc(F)cc2F)n1
InChIInChI=1S/C11H9F2N3/c12-7-4-5-9(8(13)6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H3,14,15,16)
InChIKeyYYKWECMNNOGDPS-UHFFFAOYSA-N
MW221.21 g/mol
LogP2.69
Rot. Bonds2

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

6-N-(2,4-difluorophenyl)pyridine-2,6-diamine (PubChem CID 80647983) has the molecular formula C11H9F2N3 and a molecular weight of 221.21 g/mol. Its IUPAC name is 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(2,4-difluorophenyl)pyridine-2,6-diamine
PubChem CID80647983
Molecular FormulaC11H9F2N3
Molecular Weight221.21 g/mol
Exact Mass221.08
IUPAC Name6-N-(2,4-difluorophenyl)pyridine-2,6-diamine
SMILESNc1cccc(Nc2ccc(F)cc2F)n1
InChIInChI=1S/C11H9F2N3/c12-7-4-5-9(8(13)6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H3,14,15,16)
InChIKeyYYKWECMNNOGDPS-UHFFFAOYSA-N
XLogP2.69
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.21
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine?
The IUPAC name of 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine (CID 80647983) is 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine.
What is the SMILES notation for 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine?
The canonical SMILES for 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine is Nc1cccc(Nc2ccc(F)cc2F)n1.
What is the InChIKey of 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine?
The InChIKey is YYKWECMNNOGDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F2N3/c12-7-4-5-9(8(13)6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H3,14,15,16).
What are the key properties of 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine?
6-N-(2,4-difluorophenyl)pyridine-2,6-diamine has a molecular weight of 221.21 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2,4-difluorophenyl)pyridine-2,6-diamine is sourced from PubChem (CID 80647983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).