6-bromo-4-fluoropyridin-2-amine

C5H4BrFN2 — CID 130713421

IUPAC6-bromo-4-fluoropyridin-2-amine
SMILESNc1cc(F)cc(Br)n1
InChIInChI=1S/C5H4BrFN2/c6-4-1-3(7)2-5(8)9-4/h1-2H,(H2,8,9)
InChIKeyHIQCMTIZDUGLLT-UHFFFAOYSA-N
MW191.00 g/mol
LogP1.57
Rot. Bonds

About 6-bromo-4-fluoropyridin-2-amine

6-bromo-4-fluoropyridin-2-amine (PubChem CID 130713421) has the molecular formula C5H4BrFN2 and a molecular weight of 191.00 g/mol. Its IUPAC name is 6-bromo-4-fluoropyridin-2-amine.

Molecular Properties

Compound Name6-bromo-4-fluoropyridin-2-amine
PubChem CID130713421
Molecular FormulaC5H4BrFN2
Molecular Weight191.00 g/mol
Exact Mass189.95
IUPAC Name6-bromo-4-fluoropyridin-2-amine
SMILESNc1cc(F)cc(Br)n1
InChIInChI=1S/C5H4BrFN2/c6-4-1-3(7)2-5(8)9-4/h1-2H,(H2,8,9)
InChIKeyHIQCMTIZDUGLLT-UHFFFAOYSA-N
XLogP1.57
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.00
LogP ≤ 51.57
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 6-bromo-4-fluoropyridin-2-amine?
The IUPAC name of 6-bromo-4-fluoropyridin-2-amine (CID 130713421) is 6-bromo-4-fluoropyridin-2-amine.
What is the SMILES notation for 6-bromo-4-fluoropyridin-2-amine?
The canonical SMILES for 6-bromo-4-fluoropyridin-2-amine is Nc1cc(F)cc(Br)n1.
What is the InChIKey of 6-bromo-4-fluoropyridin-2-amine?
The InChIKey is HIQCMTIZDUGLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4BrFN2/c6-4-1-3(7)2-5(8)9-4/h1-2H,(H2,8,9).
What are the key properties of 6-bromo-4-fluoropyridin-2-amine?
6-bromo-4-fluoropyridin-2-amine has a molecular weight of 191.00 g/mol, XLogP of 1.57, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-fluoropyridin-2-amine is sourced from PubChem (CID 130713421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).