4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione

C10H11N5O3 — CID 66061854

IUPAC4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione
SMILESNNc1ccc(C(=O)N2CC(=O)NC(=O)C2)cn1
InChIInChI=1S/C10H11N5O3/c11-14-7-2-1-6(3-12-7)10(18)15-4-8(16)13-9(17)5-15/h1-3H,4-5,11H2,(H,12,14)(H,13,16,17)
InChIKeyWNOJTKHHPCDKQX-UHFFFAOYSA-N
MW249.23 g/mol
LogP-1.53
Rot. Bonds2

About 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione

4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione (PubChem CID 66061854) has the molecular formula C10H11N5O3 and a molecular weight of 249.23 g/mol. Its IUPAC name is 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione.

Molecular Properties

Compound Name4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione
PubChem CID66061854
Molecular FormulaC10H11N5O3
Molecular Weight249.23 g/mol
Exact Mass249.09
IUPAC Name4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione
SMILESNNc1ccc(C(=O)N2CC(=O)NC(=O)C2)cn1
InChIInChI=1S/C10H11N5O3/c11-14-7-2-1-6(3-12-7)10(18)15-4-8(16)13-9(17)5-15/h1-3H,4-5,11H2,(H,12,14)(H,13,16,17)
InChIKeyWNOJTKHHPCDKQX-UHFFFAOYSA-N
XLogP-1.53
TPSA117.42 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.23
LogP ≤ 5-1.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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'}

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Frequently Asked Questions

What is the IUPAC name of 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione?
The IUPAC name of 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione (CID 66061854) is 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione.
What is the SMILES notation for 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione?
The canonical SMILES for 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione is NNc1ccc(C(=O)N2CC(=O)NC(=O)C2)cn1.
What is the InChIKey of 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione?
The InChIKey is WNOJTKHHPCDKQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O3/c11-14-7-2-1-6(3-12-7)10(18)15-4-8(16)13-9(17)5-15/h1-3H,4-5,11H2,(H,12,14)(H,13,16,17).
What are the key properties of 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione?
4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione has a molecular weight of 249.23 g/mol, XLogP of -1.53, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-hydrazinylpyridine-3-carbonyl)piperazine-2,6-dione is sourced from PubChem (CID 66061854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).