3,5-difluoropyridine-2,6-diamine

C5H5F2N3 — CID 10176199

IUPAC3,5-difluoropyridine-2,6-diamine
SMILESNc1nc(N)c(F)cc1F
InChIInChI=1S/C5H5F2N3/c6-2-1-3(7)5(9)10-4(2)8/h1H,(H4,8,9,10)
InChIKeyGCIUCMRUMOAHKR-UHFFFAOYSA-N
MW145.11 g/mol
LogP0.52
Rot. Bonds

About 3,5-difluoropyridine-2,6-diamine

3,5-difluoropyridine-2,6-diamine (PubChem CID 10176199) has the molecular formula C5H5F2N3 and a molecular weight of 145.11 g/mol. Its IUPAC name is 3,5-difluoropyridine-2,6-diamine.

Molecular Properties

Compound Name3,5-difluoropyridine-2,6-diamine
PubChem CID10176199
Molecular FormulaC5H5F2N3
Molecular Weight145.11 g/mol
Exact Mass145.05
IUPAC Name3,5-difluoropyridine-2,6-diamine
SMILESNc1nc(N)c(F)cc1F
InChIInChI=1S/C5H5F2N3/c6-2-1-3(7)5(9)10-4(2)8/h1H,(H4,8,9,10)
InChIKeyGCIUCMRUMOAHKR-UHFFFAOYSA-N
XLogP0.52
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.11
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-difluoropyridine-2,6-diamine?
The IUPAC name of 3,5-difluoropyridine-2,6-diamine (CID 10176199) is 3,5-difluoropyridine-2,6-diamine.
What is the SMILES notation for 3,5-difluoropyridine-2,6-diamine?
The canonical SMILES for 3,5-difluoropyridine-2,6-diamine is Nc1nc(N)c(F)cc1F.
What is the InChIKey of 3,5-difluoropyridine-2,6-diamine?
The InChIKey is GCIUCMRUMOAHKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F2N3/c6-2-1-3(7)5(9)10-4(2)8/h1H,(H4,8,9,10).
What are the key properties of 3,5-difluoropyridine-2,6-diamine?
3,5-difluoropyridine-2,6-diamine has a molecular weight of 145.11 g/mol, XLogP of 0.52, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoropyridine-2,6-diamine is sourced from PubChem (CID 10176199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).