3,6-difluoro-5-methylpyridin-2-amine

C6H6F2N2 — CID 135201533

IUPAC3,6-difluoro-5-methylpyridin-2-amine
SMILESCc1cc(F)c(N)nc1F
InChIInChI=1S/C6H6F2N2/c1-3-2-4(7)6(9)10-5(3)8/h2H,1H3,(H2,9,10)
InChIKeyAFVKHAVWLBNIJM-UHFFFAOYSA-N
MW144.12 g/mol
LogP1.25
Rot. Bonds

About 3,6-difluoro-5-methylpyridin-2-amine

3,6-difluoro-5-methylpyridin-2-amine (PubChem CID 135201533) has the molecular formula C6H6F2N2 and a molecular weight of 144.12 g/mol. Its IUPAC name is 3,6-difluoro-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3,6-difluoro-5-methylpyridin-2-amine
PubChem CID135201533
Molecular FormulaC6H6F2N2
Molecular Weight144.12 g/mol
Exact Mass144.05
IUPAC Name3,6-difluoro-5-methylpyridin-2-amine
SMILESCc1cc(F)c(N)nc1F
InChIInChI=1S/C6H6F2N2/c1-3-2-4(7)6(9)10-5(3)8/h2H,1H3,(H2,9,10)
InChIKeyAFVKHAVWLBNIJM-UHFFFAOYSA-N
XLogP1.25
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.12
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,6-difluoro-5-methylpyridin-2-amine?
The IUPAC name of 3,6-difluoro-5-methylpyridin-2-amine (CID 135201533) is 3,6-difluoro-5-methylpyridin-2-amine.
What is the SMILES notation for 3,6-difluoro-5-methylpyridin-2-amine?
The canonical SMILES for 3,6-difluoro-5-methylpyridin-2-amine is Cc1cc(F)c(N)nc1F.
What is the InChIKey of 3,6-difluoro-5-methylpyridin-2-amine?
The InChIKey is AFVKHAVWLBNIJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2N2/c1-3-2-4(7)6(9)10-5(3)8/h2H,1H3,(H2,9,10).
What are the key properties of 3,6-difluoro-5-methylpyridin-2-amine?
3,6-difluoro-5-methylpyridin-2-amine has a molecular weight of 144.12 g/mol, XLogP of 1.25, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-difluoro-5-methylpyridin-2-amine is sourced from PubChem (CID 135201533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).