2-(2,2-difluoroethylsulfinyl)pyridin-3-amine

C7H8F2N2OS — CID 61367922

IUPAC2-(2,2-difluoroethylsulfinyl)pyridin-3-amine
SMILESNc1cccnc1S(=O)CC(F)F
InChIInChI=1S/C7H8F2N2OS/c8-6(9)4-13(12)7-5(10)2-1-3-11-7/h1-3,6H,4,10H2
InChIKeyHJWKANPASXXSDF-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.04
Rot. Bonds3

About 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine

2-(2,2-difluoroethylsulfinyl)pyridin-3-amine (PubChem CID 61367922) has the molecular formula C7H8F2N2OS and a molecular weight of 206.22 g/mol. Its IUPAC name is 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine.

Molecular Properties

Compound Name2-(2,2-difluoroethylsulfinyl)pyridin-3-amine
PubChem CID61367922
Molecular FormulaC7H8F2N2OS
Molecular Weight206.22 g/mol
Exact Mass206.03
IUPAC Name2-(2,2-difluoroethylsulfinyl)pyridin-3-amine
SMILESNc1cccnc1S(=O)CC(F)F
InChIInChI=1S/C7H8F2N2OS/c8-6(9)4-13(12)7-5(10)2-1-3-11-7/h1-3,6H,4,10H2
InChIKeyHJWKANPASXXSDF-UHFFFAOYSA-N
XLogP1.04
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine?
The IUPAC name of 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine (CID 61367922) is 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine.
What is the SMILES notation for 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine?
The canonical SMILES for 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine is Nc1cccnc1S(=O)CC(F)F.
What is the InChIKey of 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine?
The InChIKey is HJWKANPASXXSDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2OS/c8-6(9)4-13(12)7-5(10)2-1-3-11-7/h1-3,6H,4,10H2.
What are the key properties of 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine?
2-(2,2-difluoroethylsulfinyl)pyridin-3-amine has a molecular weight of 206.22 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluoroethylsulfinyl)pyridin-3-amine is sourced from PubChem (CID 61367922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).