2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide

C10H8ClN3O3S — CID 112573090

IUPAC2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1Oc1cncc(Cl)c1
InChIInChI=1S/C10H8ClN3O3S/c11-7-4-8(6-13-5-7)17-10-9(18(12,15)16)2-1-3-14-10/h1-6H,(H2,12,15,16)
InChIKeyKHYMSIWSOAIFDJ-UHFFFAOYSA-N
MW285.71 g/mol
LogP1.57
Rot. Bonds3

About 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide

2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide (PubChem CID 112573090) has the molecular formula C10H8ClN3O3S and a molecular weight of 285.71 g/mol. Its IUPAC name is 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide
PubChem CID112573090
Molecular FormulaC10H8ClN3O3S
Molecular Weight285.71 g/mol
Exact Mass285.00
IUPAC Name2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1Oc1cncc(Cl)c1
InChIInChI=1S/C10H8ClN3O3S/c11-7-4-8(6-13-5-7)17-10-9(18(12,15)16)2-1-3-14-10/h1-6H,(H2,12,15,16)
InChIKeyKHYMSIWSOAIFDJ-UHFFFAOYSA-N
XLogP1.57
TPSA95.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.71
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide?
The IUPAC name of 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide (CID 112573090) is 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide.
What is the SMILES notation for 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide?
The canonical SMILES for 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide is NS(=O)(=O)c1cccnc1Oc1cncc(Cl)c1.
What is the InChIKey of 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide?
The InChIKey is KHYMSIWSOAIFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3O3S/c11-7-4-8(6-13-5-7)17-10-9(18(12,15)16)2-1-3-14-10/h1-6H,(H2,12,15,16).
What are the key properties of 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide?
2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide has a molecular weight of 285.71 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-3-pyridinyl)oxy]pyridine-3-sulfonamide is sourced from PubChem (CID 112573090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).