(2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride

C10H11ClN4O4 — CID 18517145

IUPAC(2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride
SMILESCl.NNc1ncccc1C(=O)ON1C(=O)CCC1=O
InChIInChI=1S/C10H10N4O4.ClH/c11-13-9-6(2-1-5-12-9)10(17)18-14-7(15)3-4-8(14)16;/h1-2,5H,3-4,11H2,(H,12,13);1H
InChIKeySEINBTMBDWHSBZ-UHFFFAOYSA-N
MW286.67 g/mol
LogP0.01
Rot. Bonds3

About (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride

(2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride (PubChem CID 18517145) has the molecular formula C10H11ClN4O4 and a molecular weight of 286.67 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride.

Molecular Properties

Compound Name(2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride
PubChem CID18517145
Molecular FormulaC10H11ClN4O4
Molecular Weight286.67 g/mol
Exact Mass286.05
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride
SMILESCl.NNc1ncccc1C(=O)ON1C(=O)CCC1=O
InChIInChI=1S/C10H10N4O4.ClH/c11-13-9-6(2-1-5-12-9)10(17)18-14-7(15)3-4-8(14)16;/h1-2,5H,3-4,11H2,(H,12,13);1H
InChIKeySEINBTMBDWHSBZ-UHFFFAOYSA-N
XLogP0.01
TPSA114.62 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.67
LogP ≤ 50.01
H-Bond Donors ≤ 52
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'}

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Frequently Asked Questions

What is the IUPAC name of (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride?
The IUPAC name of (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride (CID 18517145) is (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride.
What is the SMILES notation for (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride?
The canonical SMILES for (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride is Cl.NNc1ncccc1C(=O)ON1C(=O)CCC1=O.
What is the InChIKey of (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride?
The InChIKey is SEINBTMBDWHSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O4.ClH/c11-13-9-6(2-1-5-12-9)10(17)18-14-7(15)3-4-8(14)16;/h1-2,5H,3-4,11H2,(H,12,13);1H.
What are the key properties of (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride?
(2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride has a molecular weight of 286.67 g/mol, XLogP of 0.01, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dioxopyrrolidin-1-yl) 2-hydrazinylpyridine-3-carboxylate;hydrochloride is sourced from PubChem (CID 18517145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).