3,5-dichloro-6-methylsulfanylpyridin-2-amine

C6H6Cl2N2S — CID 102761414

IUPAC3,5-dichloro-6-methylsulfanylpyridin-2-amine
SMILESCSc1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C6H6Cl2N2S/c1-11-6-4(8)2-3(7)5(9)10-6/h2H,1H3,(H2,9,10)
InChIKeyOMLWRDKGSJBALA-UHFFFAOYSA-N
MW209.10 g/mol
LogP2.69
Rot. Bonds1

About 3,5-dichloro-6-methylsulfanylpyridin-2-amine

3,5-dichloro-6-methylsulfanylpyridin-2-amine (PubChem CID 102761414) has the molecular formula C6H6Cl2N2S and a molecular weight of 209.10 g/mol. Its IUPAC name is 3,5-dichloro-6-methylsulfanylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-methylsulfanylpyridin-2-amine
PubChem CID102761414
Molecular FormulaC6H6Cl2N2S
Molecular Weight209.10 g/mol
Exact Mass207.96
IUPAC Name3,5-dichloro-6-methylsulfanylpyridin-2-amine
SMILESCSc1nc(N)c(Cl)cc1Cl
InChIInChI=1S/C6H6Cl2N2S/c1-11-6-4(8)2-3(7)5(9)10-6/h2H,1H3,(H2,9,10)
InChIKeyOMLWRDKGSJBALA-UHFFFAOYSA-N
XLogP2.69
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.10
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-methylsulfanylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-methylsulfanylpyridin-2-amine (CID 102761414) is 3,5-dichloro-6-methylsulfanylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-methylsulfanylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-methylsulfanylpyridin-2-amine is CSc1nc(N)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-methylsulfanylpyridin-2-amine?
The InChIKey is OMLWRDKGSJBALA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6Cl2N2S/c1-11-6-4(8)2-3(7)5(9)10-6/h2H,1H3,(H2,9,10).
What are the key properties of 3,5-dichloro-6-methylsulfanylpyridin-2-amine?
3,5-dichloro-6-methylsulfanylpyridin-2-amine has a molecular weight of 209.10 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-methylsulfanylpyridin-2-amine is sourced from PubChem (CID 102761414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).