2-ethoxy-6-(1-methylsulfanylethyl)pyridine

C10H15NOS — CID 126590909

IUPAC2-ethoxy-6-(1-methylsulfanylethyl)pyridine
SMILESCCOc1cccc(C(C)SC)n1
InChIInChI=1S/C10H15NOS/c1-4-12-10-7-5-6-9(11-10)8(2)13-3/h5-8H,4H2,1-3H3
InChIKeyLAYPCNSDWMYZBQ-UHFFFAOYSA-N
MW197.30 g/mol
LogP2.90
Rot. Bonds4

About 2-ethoxy-6-(1-methylsulfanylethyl)pyridine

2-ethoxy-6-(1-methylsulfanylethyl)pyridine (PubChem CID 126590909) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is 2-ethoxy-6-(1-methylsulfanylethyl)pyridine.

Molecular Properties

Compound Name2-ethoxy-6-(1-methylsulfanylethyl)pyridine
PubChem CID126590909
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name2-ethoxy-6-(1-methylsulfanylethyl)pyridine
SMILESCCOc1cccc(C(C)SC)n1
InChIInChI=1S/C10H15NOS/c1-4-12-10-7-5-6-9(11-10)8(2)13-3/h5-8H,4H2,1-3H3
InChIKeyLAYPCNSDWMYZBQ-UHFFFAOYSA-N
XLogP2.90
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-6-(1-methylsulfanylethyl)pyridine?
The IUPAC name of 2-ethoxy-6-(1-methylsulfanylethyl)pyridine (CID 126590909) is 2-ethoxy-6-(1-methylsulfanylethyl)pyridine.
What is the SMILES notation for 2-ethoxy-6-(1-methylsulfanylethyl)pyridine?
The canonical SMILES for 2-ethoxy-6-(1-methylsulfanylethyl)pyridine is CCOc1cccc(C(C)SC)n1.
What is the InChIKey of 2-ethoxy-6-(1-methylsulfanylethyl)pyridine?
The InChIKey is LAYPCNSDWMYZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c1-4-12-10-7-5-6-9(11-10)8(2)13-3/h5-8H,4H2,1-3H3.
What are the key properties of 2-ethoxy-6-(1-methylsulfanylethyl)pyridine?
2-ethoxy-6-(1-methylsulfanylethyl)pyridine has a molecular weight of 197.30 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-6-(1-methylsulfanylethyl)pyridine is sourced from PubChem (CID 126590909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).