5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine

C8H11FN2S — CID 144516161

IUPAC5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine
SMILESCSCCc1ncc(N)cc1F
InChIInChI=1S/C8H11FN2S/c1-12-3-2-8-7(9)4-6(10)5-11-8/h4-5H,2-3,10H2,1H3
InChIKeyHYUHOWXIKGJITE-UHFFFAOYSA-N
MW186.26 g/mol
LogP1.71
Rot. Bonds3

About 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine

5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine (PubChem CID 144516161) has the molecular formula C8H11FN2S and a molecular weight of 186.26 g/mol. Its IUPAC name is 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine.

Molecular Properties

Compound Name5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine
PubChem CID144516161
Molecular FormulaC8H11FN2S
Molecular Weight186.26 g/mol
Exact Mass186.06
IUPAC Name5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine
SMILESCSCCc1ncc(N)cc1F
InChIInChI=1S/C8H11FN2S/c1-12-3-2-8-7(9)4-6(10)5-11-8/h4-5H,2-3,10H2,1H3
InChIKeyHYUHOWXIKGJITE-UHFFFAOYSA-N
XLogP1.71
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine?
The IUPAC name of 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine (CID 144516161) is 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine.
What is the SMILES notation for 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine?
The canonical SMILES for 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine is CSCCc1ncc(N)cc1F.
What is the InChIKey of 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine?
The InChIKey is HYUHOWXIKGJITE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2S/c1-12-3-2-8-7(9)4-6(10)5-11-8/h4-5H,2-3,10H2,1H3.
What are the key properties of 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine?
5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine has a molecular weight of 186.26 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-(2-methylsulfanylethyl)pyridin-3-amine is sourced from PubChem (CID 144516161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).