5-bromo-4-fluoro-N-methylpyridin-2-amine

C6H6BrFN2 — CID 144888769

IUPAC5-bromo-4-fluoro-N-methylpyridin-2-amine
SMILESCNc1cc(F)c(Br)cn1
InChIInChI=1S/C6H6BrFN2/c1-9-6-2-5(8)4(7)3-10-6/h2-3H,1H3,(H,9,10)
InChIKeyZVZHRPALTYPPEA-UHFFFAOYSA-N
MW205.03 g/mol
LogP2.02
Rot. Bonds1

About 5-bromo-4-fluoro-N-methylpyridin-2-amine

5-bromo-4-fluoro-N-methylpyridin-2-amine (PubChem CID 144888769) has the molecular formula C6H6BrFN2 and a molecular weight of 205.03 g/mol. Its IUPAC name is 5-bromo-4-fluoro-N-methylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-4-fluoro-N-methylpyridin-2-amine
PubChem CID144888769
Molecular FormulaC6H6BrFN2
Molecular Weight205.03 g/mol
Exact Mass203.97
IUPAC Name5-bromo-4-fluoro-N-methylpyridin-2-amine
SMILESCNc1cc(F)c(Br)cn1
InChIInChI=1S/C6H6BrFN2/c1-9-6-2-5(8)4(7)3-10-6/h2-3H,1H3,(H,9,10)
InChIKeyZVZHRPALTYPPEA-UHFFFAOYSA-N
XLogP2.02
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.03
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-fluoro-N-methylpyridin-2-amine?
The IUPAC name of 5-bromo-4-fluoro-N-methylpyridin-2-amine (CID 144888769) is 5-bromo-4-fluoro-N-methylpyridin-2-amine.
What is the SMILES notation for 5-bromo-4-fluoro-N-methylpyridin-2-amine?
The canonical SMILES for 5-bromo-4-fluoro-N-methylpyridin-2-amine is CNc1cc(F)c(Br)cn1.
What is the InChIKey of 5-bromo-4-fluoro-N-methylpyridin-2-amine?
The InChIKey is ZVZHRPALTYPPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6BrFN2/c1-9-6-2-5(8)4(7)3-10-6/h2-3H,1H3,(H,9,10).
What are the key properties of 5-bromo-4-fluoro-N-methylpyridin-2-amine?
5-bromo-4-fluoro-N-methylpyridin-2-amine has a molecular weight of 205.03 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-fluoro-N-methylpyridin-2-amine is sourced from PubChem (CID 144888769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).