3-(ethylsulfanylmethyl)pyridine

C8H11NS — CID 3025109

IUPAC3-(ethylsulfanylmethyl)pyridine
SMILESCCSCc1cccnc1
InChIInChI=1S/C8H11NS/c1-2-10-7-8-4-3-5-9-6-8/h3-6H,2,7H2,1H3
InChIKeyZAZDQWPWEXULPL-UHFFFAOYSA-N
MW153.25 g/mol
LogP2.33
Rot. Bonds3

About 3-(ethylsulfanylmethyl)pyridine

3-(ethylsulfanylmethyl)pyridine (PubChem CID 3025109) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is 3-(ethylsulfanylmethyl)pyridine.

Molecular Properties

Compound Name3-(ethylsulfanylmethyl)pyridine
PubChem CID3025109
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name3-(ethylsulfanylmethyl)pyridine
SMILESCCSCc1cccnc1
InChIInChI=1S/C8H11NS/c1-2-10-7-8-4-3-5-9-6-8/h3-6H,2,7H2,1H3
InChIKeyZAZDQWPWEXULPL-UHFFFAOYSA-N
XLogP2.33
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(ethylsulfanylmethyl)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(benzylsulfanylmethyl)pyridine
CID 3025143
2-methyl-1-(pyridin-3-ylmethylsulfanyl)propan-2-amine
CID 66230417
3-(but-2-ynylsulfanylmethyl)pyridine
CID 130709571
3-ethylpyridine
CID 10823
N-ethyl-1-ethylsulfanyl-3-pyridin-3-ylpropan-2-amine
CID 104736340
3-(pyridin-3-ylmethyl)pyridine
CID 14762640
6-(pyridin-3-ylmethylsulfanylmethyl)isoquinoline
CID 166359977
3-(ethynylsulfanylmethyl)pyridine
CID 69152778
ethane;ethylbenzene;3-ethylpyridine
CID 145171299
3-(phenylsulfanylmethyl)pyridine;hydrochloride
CID 71374325
3-[[4-(4-ethylphenyl)phenyl]methyl]pyridine
CID 143881786
3-[[2-[4,5-bis(pyridin-3-ylmethylsulfanyl)-1,3-dithiol-2-ylidene]-5-(pyridin-3-ylmethylsulfanyl)-1,3-dithiol-4-yl]sulfanylmethyl]pyridine
CID 101228131

Frequently Asked Questions

What is the IUPAC name of 3-(ethylsulfanylmethyl)pyridine?
The IUPAC name of 3-(ethylsulfanylmethyl)pyridine (CID 3025109) is 3-(ethylsulfanylmethyl)pyridine.
What is the SMILES notation for 3-(ethylsulfanylmethyl)pyridine?
The canonical SMILES for 3-(ethylsulfanylmethyl)pyridine is CCSCc1cccnc1.
What is the InChIKey of 3-(ethylsulfanylmethyl)pyridine?
The InChIKey is ZAZDQWPWEXULPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NS/c1-2-10-7-8-4-3-5-9-6-8/h3-6H,2,7H2,1H3.
What are the key properties of 3-(ethylsulfanylmethyl)pyridine?
3-(ethylsulfanylmethyl)pyridine has a molecular weight of 153.25 g/mol, XLogP of 2.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylsulfanylmethyl)pyridine is sourced from PubChem (CID 3025109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).