2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid

C10H10N4O4 — CID 141110137

IUPAC2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1NNN1C(=O)CCC1=O
InChIInChI=1S/C10H10N4O4/c15-7-3-4-8(16)14(7)13-12-9-6(10(17)18)2-1-5-11-9/h1-2,5,13H,3-4H2,(H,11,12)(H,17,18)
InChIKeyMXRQIUZQWOPPPI-UHFFFAOYSA-N
MW250.21 g/mol
LogP-0.24
Rot. Bonds4

About 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid

2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid (PubChem CID 141110137) has the molecular formula C10H10N4O4 and a molecular weight of 250.21 g/mol. Its IUPAC name is 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid
PubChem CID141110137
Molecular FormulaC10H10N4O4
Molecular Weight250.21 g/mol
Exact Mass250.07
IUPAC Name2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1NNN1C(=O)CCC1=O
InChIInChI=1S/C10H10N4O4/c15-7-3-4-8(16)14(7)13-12-9-6(10(17)18)2-1-5-11-9/h1-2,5,13H,3-4H2,(H,11,12)(H,17,18)
InChIKeyMXRQIUZQWOPPPI-UHFFFAOYSA-N
XLogP-0.24
TPSA111.63 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.21
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'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-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid?
The IUPAC name of 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid (CID 141110137) is 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid?
The canonical SMILES for 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid is O=C(O)c1cccnc1NNN1C(=O)CCC1=O.
What is the InChIKey of 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid?
The InChIKey is MXRQIUZQWOPPPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O4/c15-7-3-4-8(16)14(7)13-12-9-6(10(17)18)2-1-5-11-9/h1-2,5,13H,3-4H2,(H,11,12)(H,17,18).
What are the key properties of 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid?
2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid has a molecular weight of 250.21 g/mol, XLogP of -0.24, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,5-dioxopyrrolidin-1-yl)hydrazinyl]pyridine-3-carboxylic acid is sourced from PubChem (CID 141110137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).