N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide

C10H11F3N2O3S — CID 84600733

IUPACN-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NC1CCOC1)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C10H11F3N2O3S/c11-10(12,13)9-2-1-8(5-14-9)19(16,17)15-7-3-4-18-6-7/h1-2,5,7,15H,3-4,6H2
InChIKeyQOECDZWAULCNGG-UHFFFAOYSA-N
MW296.27 g/mol
LogP1.17
Rot. Bonds3

About N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide

N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide (PubChem CID 84600733) has the molecular formula C10H11F3N2O3S and a molecular weight of 296.27 g/mol. Its IUPAC name is N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide
PubChem CID84600733
Molecular FormulaC10H11F3N2O3S
Molecular Weight296.27 g/mol
Exact Mass296.04
IUPAC NameN-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NC1CCOC1)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C10H11F3N2O3S/c11-10(12,13)9-2-1-8(5-14-9)19(16,17)15-7-3-4-18-6-7/h1-2,5,7,15H,3-4,6H2
InChIKeyQOECDZWAULCNGG-UHFFFAOYSA-N
XLogP1.17
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.27
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide?
The IUPAC name of N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide (CID 84600733) is N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide?
The canonical SMILES for N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide is O=S(=O)(NC1CCOC1)c1ccc(C(F)(F)F)nc1.
What is the InChIKey of N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide?
The InChIKey is QOECDZWAULCNGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O3S/c11-10(12,13)9-2-1-8(5-14-9)19(16,17)15-7-3-4-18-6-7/h1-2,5,7,15H,3-4,6H2.
What are the key properties of N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide?
N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide has a molecular weight of 296.27 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-yl)-6-(trifluoromethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 84600733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).