4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione

C8H6FNS2 — CID 121405858

IUPAC4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione
SMILESCn1cc(F)c2ccsc2c1=S
InChIInChI=1S/C8H6FNS2/c1-10-4-6(9)5-2-3-12-7(5)8(10)11/h2-4H,1H3
InChIKeyHPYDOVITQOWLRG-UHFFFAOYSA-N
MW199.28 g/mol
LogP3.11
Rot. Bonds

About 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione

4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione (PubChem CID 121405858) has the molecular formula C8H6FNS2 and a molecular weight of 199.28 g/mol. Its IUPAC name is 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione.

Molecular Properties

Compound Name4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione
PubChem CID121405858
Molecular FormulaC8H6FNS2
Molecular Weight199.28 g/mol
Exact Mass198.99
IUPAC Name4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione
SMILESCn1cc(F)c2ccsc2c1=S
InChIInChI=1S/C8H6FNS2/c1-10-4-6(9)5-2-3-12-7(5)8(10)11/h2-4H,1H3
InChIKeyHPYDOVITQOWLRG-UHFFFAOYSA-N
XLogP3.11
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Related Compounds

6-(trifluoromethylsulfonyl)-7H-thieno[2,3-c]pyridine
CID 154721474
2-(Dimethylamino)methyl-3-methylthiophene
CID 10080668
Thienoquinolizine
CID 67258030
6-Methylthieno[2,3-c]pyridine-7-thione
CID 121405862
6-Tert-butyl-4-fluoro-7-methylidenethieno[2,3-c]pyridine
CID 121403786
6-Tert-butyl-4-fluorothieno[2,3-c]pyridine-7-thione
CID 126503372
4-fluoro-6H-thieno[2,3-c]pyridine-7-thione
CID 137412745
4-fluoro-N,N-dimethyl-7H-thieno[2,3-c]pyridin-6-amine
CID 139321135
4-Fluoro-6-(2-methylbutan-2-yl)thieno[2,3-c]pyridine-7-thione
CID 146276515
4-Fluoro-6-(methylamino)thieno[2,3-c]pyridine-7-thione
CID 146497712
6-(Dimethylamino)-4-fluorothieno[2,3-c]pyridine-7-thione
CID 147429568
4-fluoro-6-propan-2-yl-7H-thieno[2,3-c]pyridine
CID 154964411

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione?
The IUPAC name of 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione (CID 121405858) is 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione.
What is the SMILES notation for 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione?
The canonical SMILES for 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione is Cn1cc(F)c2ccsc2c1=S.
What is the InChIKey of 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione?
The InChIKey is HPYDOVITQOWLRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FNS2/c1-10-4-6(9)5-2-3-12-7(5)8(10)11/h2-4H,1H3.
What are the key properties of 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione?
4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione has a molecular weight of 199.28 g/mol, XLogP of 3.11, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-methylthieno[2,3-c]pyridine-7-thione is sourced from PubChem (CID 121405858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).