4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione

C9H11N5O4S — CID 66063379

IUPAC4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione
SMILESNNc1ccc(S(=O)(=O)N2CC(=O)NC(=O)C2)cn1
InChIInChI=1S/C9H11N5O4S/c10-13-7-2-1-6(3-11-7)19(17,18)14-4-8(15)12-9(16)5-14/h1-3H,4-5,10H2,(H,11,13)(H,12,15,16)
InChIKeyOXIWHCCRMNZFFY-UHFFFAOYSA-N
MW285.28 g/mol
LogP-1.99
Rot. Bonds3

About 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione

4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione (PubChem CID 66063379) has the molecular formula C9H11N5O4S and a molecular weight of 285.28 g/mol. Its IUPAC name is 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione.

Molecular Properties

Compound Name4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione
PubChem CID66063379
Molecular FormulaC9H11N5O4S
Molecular Weight285.28 g/mol
Exact Mass285.05
IUPAC Name4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione
SMILESNNc1ccc(S(=O)(=O)N2CC(=O)NC(=O)C2)cn1
InChIInChI=1S/C9H11N5O4S/c10-13-7-2-1-6(3-11-7)19(17,18)14-4-8(15)12-9(16)5-14/h1-3H,4-5,10H2,(H,11,13)(H,12,15,16)
InChIKeyOXIWHCCRMNZFFY-UHFFFAOYSA-N
XLogP-1.99
TPSA134.49 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.28
LogP ≤ 5-1.99
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'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione?
The IUPAC name of 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione (CID 66063379) is 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione.
What is the SMILES notation for 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione?
The canonical SMILES for 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione is NNc1ccc(S(=O)(=O)N2CC(=O)NC(=O)C2)cn1.
What is the InChIKey of 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione?
The InChIKey is OXIWHCCRMNZFFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O4S/c10-13-7-2-1-6(3-11-7)19(17,18)14-4-8(15)12-9(16)5-14/h1-3H,4-5,10H2,(H,11,13)(H,12,15,16).
What are the key properties of 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione?
4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione has a molecular weight of 285.28 g/mol, XLogP of -1.99, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione is sourced from PubChem (CID 66063379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).