2-(difluoromethylsulfanyl)pyridine

C6H5F2NS — CID 10583103

IUPAC2-(difluoromethylsulfanyl)pyridine
SMILESFC(F)Sc1ccccn1
InChIInChI=1S/C6H5F2NS/c7-6(8)10-5-3-1-2-4-9-5/h1-4,6H
InChIKeyUGNCMUSLJBGOQW-UHFFFAOYSA-N
MW161.18 g/mol
LogP2.40
Rot. Bonds2

About 2-(difluoromethylsulfanyl)pyridine

2-(difluoromethylsulfanyl)pyridine (PubChem CID 10583103) has the molecular formula C6H5F2NS and a molecular weight of 161.18 g/mol. Its IUPAC name is 2-(difluoromethylsulfanyl)pyridine.

Molecular Properties

Compound Name2-(difluoromethylsulfanyl)pyridine
PubChem CID10583103
Molecular FormulaC6H5F2NS
Molecular Weight161.18 g/mol
Exact Mass161.01
IUPAC Name2-(difluoromethylsulfanyl)pyridine
SMILESFC(F)Sc1ccccn1
InChIInChI=1S/C6H5F2NS/c7-6(8)10-5-3-1-2-4-9-5/h1-4,6H
InChIKeyUGNCMUSLJBGOQW-UHFFFAOYSA-N
XLogP2.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.18
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(Pyridin-2-ylsulfanyl)-acetic acid
CID 654661
4-(Phenylthio)pyridine
CID 99184
2-Phenylthiopyridine
CID 817760
2-(Methyldithio)Pyridine-N-Oxide
CID 13386157
3-Mercaptopyridine
CID 27691
Pyridine, 2-(methylthio)-
CID 29076
2-(Methylsulfonyl)pyridine
CID 98667
Pyridine, 2-(4-trifluoromethylbenzylthio)-
CID 556666
2-((Methylthiomethyl)Dithio)Pyridine-N-Oxide
CID 45267926
2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}pyridine
CID 5713317
4-Methanesulfonylpyridine
CID 292487
3-(Phenylsulfanyl)pyridine
CID 3813610

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethylsulfanyl)pyridine?
The IUPAC name of 2-(difluoromethylsulfanyl)pyridine (CID 10583103) is 2-(difluoromethylsulfanyl)pyridine.
What is the SMILES notation for 2-(difluoromethylsulfanyl)pyridine?
The canonical SMILES for 2-(difluoromethylsulfanyl)pyridine is FC(F)Sc1ccccn1.
What is the InChIKey of 2-(difluoromethylsulfanyl)pyridine?
The InChIKey is UGNCMUSLJBGOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F2NS/c7-6(8)10-5-3-1-2-4-9-5/h1-4,6H.
What are the key properties of 2-(difluoromethylsulfanyl)pyridine?
2-(difluoromethylsulfanyl)pyridine has a molecular weight of 161.18 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethylsulfanyl)pyridine is sourced from PubChem (CID 10583103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).