5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide

C11H12ClN5O3S — CID 64606447

IUPAC5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cnc(NN)c(Cl)c2)cn1
InChIInChI=1S/C11H12ClN5O3S/c1-20-10-3-2-7(5-14-10)17-21(18,19)8-4-9(12)11(16-13)15-6-8/h2-6,17H,13H2,1H3,(H,15,16)
InChIKeyFRBYCPDINOQDTO-UHFFFAOYSA-N
MW329.77 g/mol
LogP1.23
Rot. Bonds5

About 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide

5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide (PubChem CID 64606447) has the molecular formula C11H12ClN5O3S and a molecular weight of 329.77 g/mol. Its IUPAC name is 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
PubChem CID64606447
Molecular FormulaC11H12ClN5O3S
Molecular Weight329.77 g/mol
Exact Mass329.03
IUPAC Name5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cnc(NN)c(Cl)c2)cn1
InChIInChI=1S/C11H12ClN5O3S/c1-20-10-3-2-7(5-14-10)17-21(18,19)8-4-9(12)11(16-13)15-6-8/h2-6,17H,13H2,1H3,(H,15,16)
InChIKeyFRBYCPDINOQDTO-UHFFFAOYSA-N
XLogP1.23
TPSA119.23 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.77
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide (CID 64606447) is 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide is COc1ccc(NS(=O)(=O)c2cnc(NN)c(Cl)c2)cn1.
What is the InChIKey of 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide?
The InChIKey is FRBYCPDINOQDTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN5O3S/c1-20-10-3-2-7(5-14-10)17-21(18,19)8-4-9(12)11(16-13)15-6-8/h2-6,17H,13H2,1H3,(H,15,16).
What are the key properties of 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide?
5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide has a molecular weight of 329.77 g/mol, XLogP of 1.23, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-hydrazinyl-N-(6-methoxy-3-pyridinyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64606447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).