N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide

C8H10F2N2O2S — CID 66730657

IUPACN-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide
SMILESO=S(=O)(NC(CF)CF)c1cccnc1
InChIInChI=1S/C8H10F2N2O2S/c9-4-7(5-10)12-15(13,14)8-2-1-3-11-6-8/h1-3,6-7,12H,4-5H2
InChIKeyVJNJUDOVYTXKSX-UHFFFAOYSA-N
MW236.24 g/mol
LogP0.67
Rot. Bonds5

About N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide

N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide (PubChem CID 66730657) has the molecular formula C8H10F2N2O2S and a molecular weight of 236.24 g/mol. Its IUPAC name is N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide
PubChem CID66730657
Molecular FormulaC8H10F2N2O2S
Molecular Weight236.24 g/mol
Exact Mass236.04
IUPAC NameN-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide
SMILESO=S(=O)(NC(CF)CF)c1cccnc1
InChIInChI=1S/C8H10F2N2O2S/c9-4-7(5-10)12-15(13,14)8-2-1-3-11-6-8/h1-3,6-7,12H,4-5H2
InChIKeyVJNJUDOVYTXKSX-UHFFFAOYSA-N
XLogP0.67
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide (CID 66730657) is N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide is O=S(=O)(NC(CF)CF)c1cccnc1.
What is the InChIKey of N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?
The InChIKey is VJNJUDOVYTXKSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O2S/c9-4-7(5-10)12-15(13,14)8-2-1-3-11-6-8/h1-3,6-7,12H,4-5H2.
What are the key properties of N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide?
N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide has a molecular weight of 236.24 g/mol, XLogP of 0.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-difluoropropan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 66730657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).