4-(4-cyanophenoxy)pyridine-3-sulfonamide

C12H9N3O3S — CID 46703769

IUPAC4-(4-cyanophenoxy)pyridine-3-sulfonamide
SMILESN#Cc1ccc(Oc2ccncc2S(N)(=O)=O)cc1
InChIInChI=1S/C12H9N3O3S/c13-7-9-1-3-10(4-2-9)18-11-5-6-15-8-12(11)19(14,16)17/h1-6,8H,(H2,14,16,17)
InChIKeySUYXGHCYAUOKRH-UHFFFAOYSA-N
MW275.29 g/mol
LogP1.39
Rot. Bonds3

About 4-(4-cyanophenoxy)pyridine-3-sulfonamide

4-(4-cyanophenoxy)pyridine-3-sulfonamide (PubChem CID 46703769) has the molecular formula C12H9N3O3S and a molecular weight of 275.29 g/mol. Its IUPAC name is 4-(4-cyanophenoxy)pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-(4-cyanophenoxy)pyridine-3-sulfonamide
PubChem CID46703769
Molecular FormulaC12H9N3O3S
Molecular Weight275.29 g/mol
Exact Mass275.04
IUPAC Name4-(4-cyanophenoxy)pyridine-3-sulfonamide
SMILESN#Cc1ccc(Oc2ccncc2S(N)(=O)=O)cc1
InChIInChI=1S/C12H9N3O3S/c13-7-9-1-3-10(4-2-9)18-11-5-6-15-8-12(11)19(14,16)17/h1-6,8H,(H2,14,16,17)
InChIKeySUYXGHCYAUOKRH-UHFFFAOYSA-N
XLogP1.39
TPSA106.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.29
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(4-cyanophenoxy)pyridine-3-sulfonamide?
The IUPAC name of 4-(4-cyanophenoxy)pyridine-3-sulfonamide (CID 46703769) is 4-(4-cyanophenoxy)pyridine-3-sulfonamide.
What is the SMILES notation for 4-(4-cyanophenoxy)pyridine-3-sulfonamide?
The canonical SMILES for 4-(4-cyanophenoxy)pyridine-3-sulfonamide is N#Cc1ccc(Oc2ccncc2S(N)(=O)=O)cc1.
What is the InChIKey of 4-(4-cyanophenoxy)pyridine-3-sulfonamide?
The InChIKey is SUYXGHCYAUOKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O3S/c13-7-9-1-3-10(4-2-9)18-11-5-6-15-8-12(11)19(14,16)17/h1-6,8H,(H2,14,16,17).
What are the key properties of 4-(4-cyanophenoxy)pyridine-3-sulfonamide?
4-(4-cyanophenoxy)pyridine-3-sulfonamide has a molecular weight of 275.29 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyanophenoxy)pyridine-3-sulfonamide is sourced from PubChem (CID 46703769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).