2-ethylpyridine;sulfane

C7H11NS — CID 67363352

IUPAC2-ethylpyridine;sulfane
SMILESCCc1ccccn1.S
InChIInChI=1S/C7H9N.H2S/c1-2-7-5-3-4-6-8-7;/h3-6H,2H2,1H3;1H2
InChIKeyBLCCKSXIJYKSMV-UHFFFAOYSA-N
MW141.24 g/mol
LogP1.76
Rot. Bonds1

About 2-ethylpyridine;sulfane

2-ethylpyridine;sulfane (PubChem CID 67363352) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is 2-ethylpyridine;sulfane.

Molecular Properties

Compound Name2-ethylpyridine;sulfane
PubChem CID67363352
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC Name2-ethylpyridine;sulfane
SMILESCCc1ccccn1.S
InChIInChI=1S/C7H9N.H2S/c1-2-7-5-3-4-6-8-7;/h3-6H,2H2,1H3;1H2
InChIKeyBLCCKSXIJYKSMV-UHFFFAOYSA-N
XLogP1.76
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-ethylpyridine;sulfane 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

ethane;2-ethylpyridine
CID 91102000
acetylene;2-ethylpyridine
CID 145358493
ethane;2-ethylpyridine;methane
CID 142439308
2-ethylpyridine;2-methylpyridine
CID 19020939
ethane;2-ethylpyridine;propan-2-one
CID 91062133
acetic acid;2-ethylpyridine
CID 70072313
2-ethylpyridine;sulfurous acid
CID 174743952
2-ethylpyridine;methanesulfonic acid
CID 86038816
1-chlorotetradecane;2-ethylpyridine
CID 160860410
2-ethylpyridine;1-fluoro-2-methylbenzene
CID 142160976
ethane;2-ethylpyridine;methane;3-methylpyridine
CID 170793212
ethane;pyridin-2-ylmethanamine
CID 90791011

Frequently Asked Questions

What is the IUPAC name of 2-ethylpyridine;sulfane?
The IUPAC name of 2-ethylpyridine;sulfane (CID 67363352) is 2-ethylpyridine;sulfane.
What is the SMILES notation for 2-ethylpyridine;sulfane?
The canonical SMILES for 2-ethylpyridine;sulfane is CCc1ccccn1.S.
What is the InChIKey of 2-ethylpyridine;sulfane?
The InChIKey is BLCCKSXIJYKSMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N.H2S/c1-2-7-5-3-4-6-8-7;/h3-6H,2H2,1H3;1H2.
What are the key properties of 2-ethylpyridine;sulfane?
2-ethylpyridine;sulfane has a molecular weight of 141.24 g/mol, XLogP of 1.76, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylpyridine;sulfane is sourced from PubChem (CID 67363352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).