3-hydrazinyl-1H-quinoxalin-2-one

C8H8N4O — CID 693318

IUPAC3-hydrazinyl-1H-quinoxalin-2-one
SMILESNNc1nc2ccccc2[nH]c1=O
InChIInChI=1S/C8H8N4O/c9-12-7-8(13)11-6-4-2-1-3-5(6)10-7/h1-4H,9H2,(H,10,12)(H,11,13)
InChIKeyOLKUCGPQWNWDBW-UHFFFAOYSA-N
MW176.18 g/mol
LogP0.21
Rot. Bonds1

About 3-hydrazinyl-1H-quinoxalin-2-one

3-hydrazinyl-1H-quinoxalin-2-one (PubChem CID 693318) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is 3-hydrazinyl-1H-quinoxalin-2-one.

Molecular Properties

Compound Name3-hydrazinyl-1H-quinoxalin-2-one
PubChem CID693318
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC Name3-hydrazinyl-1H-quinoxalin-2-one
SMILESNNc1nc2ccccc2[nH]c1=O
InChIInChI=1S/C8H8N4O/c9-12-7-8(13)11-6-4-2-1-3-5(6)10-7/h1-4H,9H2,(H,10,12)(H,11,13)
InChIKeyOLKUCGPQWNWDBW-UHFFFAOYSA-N
XLogP0.21
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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 3-hydrazinyl-1H-quinoxalin-2-one?
The IUPAC name of 3-hydrazinyl-1H-quinoxalin-2-one (CID 693318) is 3-hydrazinyl-1H-quinoxalin-2-one.
What is the SMILES notation for 3-hydrazinyl-1H-quinoxalin-2-one?
The canonical SMILES for 3-hydrazinyl-1H-quinoxalin-2-one is NNc1nc2ccccc2[nH]c1=O.
What is the InChIKey of 3-hydrazinyl-1H-quinoxalin-2-one?
The InChIKey is OLKUCGPQWNWDBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c9-12-7-8(13)11-6-4-2-1-3-5(6)10-7/h1-4H,9H2,(H,10,12)(H,11,13).
What are the key properties of 3-hydrazinyl-1H-quinoxalin-2-one?
3-hydrazinyl-1H-quinoxalin-2-one has a molecular weight of 176.18 g/mol, XLogP of 0.21, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-1H-quinoxalin-2-one is sourced from PubChem (CID 693318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).