2,6-diethyl-4-ethylsulfanylpyridine

C11H17NS — CID 143252962

IUPAC2,6-diethyl-4-ethylsulfanylpyridine
SMILESCCSc1cc(CC)nc(CC)c1
InChIInChI=1S/C11H17NS/c1-4-9-7-11(13-6-3)8-10(5-2)12-9/h7-8H,4-6H2,1-3H3
InChIKeySIBXDQVENTZLCM-UHFFFAOYSA-N
MW195.33 g/mol
LogP3.32
Rot. Bonds4

About 2,6-diethyl-4-ethylsulfanylpyridine

2,6-diethyl-4-ethylsulfanylpyridine (PubChem CID 143252962) has the molecular formula C11H17NS and a molecular weight of 195.33 g/mol. Its IUPAC name is 2,6-diethyl-4-ethylsulfanylpyridine.

Molecular Properties

Compound Name2,6-diethyl-4-ethylsulfanylpyridine
PubChem CID143252962
Molecular FormulaC11H17NS
Molecular Weight195.33 g/mol
Exact Mass195.11
IUPAC Name2,6-diethyl-4-ethylsulfanylpyridine
SMILESCCSc1cc(CC)nc(CC)c1
InChIInChI=1S/C11H17NS/c1-4-9-7-11(13-6-3)8-10(5-2)12-9/h7-8H,4-6H2,1-3H3
InChIKeySIBXDQVENTZLCM-UHFFFAOYSA-N
XLogP3.32
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.33
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-4-ethylsulfanylpyridine?
The IUPAC name of 2,6-diethyl-4-ethylsulfanylpyridine (CID 143252962) is 2,6-diethyl-4-ethylsulfanylpyridine.
What is the SMILES notation for 2,6-diethyl-4-ethylsulfanylpyridine?
The canonical SMILES for 2,6-diethyl-4-ethylsulfanylpyridine is CCSc1cc(CC)nc(CC)c1.
What is the InChIKey of 2,6-diethyl-4-ethylsulfanylpyridine?
The InChIKey is SIBXDQVENTZLCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NS/c1-4-9-7-11(13-6-3)8-10(5-2)12-9/h7-8H,4-6H2,1-3H3.
What are the key properties of 2,6-diethyl-4-ethylsulfanylpyridine?
2,6-diethyl-4-ethylsulfanylpyridine has a molecular weight of 195.33 g/mol, XLogP of 3.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-4-ethylsulfanylpyridine is sourced from PubChem (CID 143252962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).