2,6-difluoro-3-iodopyridin-4-amine

C5H3F2IN2 — CID 162518581

IUPAC2,6-difluoro-3-iodopyridin-4-amine
SMILESNc1cc(F)nc(F)c1I
InChIInChI=1S/C5H3F2IN2/c6-3-1-2(9)4(8)5(7)10-3/h1H,(H2,9,10)
InChIKeyDULAEANJWOIQGG-UHFFFAOYSA-N
MW255.99 g/mol
LogP1.55
Rot. Bonds

About 2,6-difluoro-3-iodopyridin-4-amine

2,6-difluoro-3-iodopyridin-4-amine (PubChem CID 162518581) has the molecular formula C5H3F2IN2 and a molecular weight of 255.99 g/mol. Its IUPAC name is 2,6-difluoro-3-iodopyridin-4-amine.

Molecular Properties

Compound Name2,6-difluoro-3-iodopyridin-4-amine
PubChem CID162518581
Molecular FormulaC5H3F2IN2
Molecular Weight255.99 g/mol
Exact Mass255.93
IUPAC Name2,6-difluoro-3-iodopyridin-4-amine
SMILESNc1cc(F)nc(F)c1I
InChIInChI=1S/C5H3F2IN2/c6-3-1-2(9)4(8)5(7)10-3/h1H,(H2,9,10)
InChIKeyDULAEANJWOIQGG-UHFFFAOYSA-N
XLogP1.55
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.99
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-3-iodopyridin-4-amine?
The IUPAC name of 2,6-difluoro-3-iodopyridin-4-amine (CID 162518581) is 2,6-difluoro-3-iodopyridin-4-amine.
What is the SMILES notation for 2,6-difluoro-3-iodopyridin-4-amine?
The canonical SMILES for 2,6-difluoro-3-iodopyridin-4-amine is Nc1cc(F)nc(F)c1I.
What is the InChIKey of 2,6-difluoro-3-iodopyridin-4-amine?
The InChIKey is DULAEANJWOIQGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3F2IN2/c6-3-1-2(9)4(8)5(7)10-3/h1H,(H2,9,10).
What are the key properties of 2,6-difluoro-3-iodopyridin-4-amine?
2,6-difluoro-3-iodopyridin-4-amine has a molecular weight of 255.99 g/mol, XLogP of 1.55, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-3-iodopyridin-4-amine is sourced from PubChem (CID 162518581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).