6-oxo-1H-pyridazine-5-carbohydrazide

C5H6N4O2 — CID 45122800

IUPAC6-oxo-1H-pyridazine-5-carbohydrazide
SMILESNNC(=O)c1ccn[nH]c1=O
InChIInChI=1S/C5H6N4O2/c6-8-4(10)3-1-2-7-9-5(3)11/h1-2H,6H2,(H,8,10)(H,9,11)
InChIKeyPIJZPMBSSLXALM-UHFFFAOYSA-N
MW154.13 g/mol
LogP-1.63
Rot. Bonds1

About 6-oxo-1H-pyridazine-5-carbohydrazide

6-oxo-1H-pyridazine-5-carbohydrazide (PubChem CID 45122800) has the molecular formula C5H6N4O2 and a molecular weight of 154.13 g/mol. Its IUPAC name is 6-oxo-1H-pyridazine-5-carbohydrazide.

Molecular Properties

Compound Name6-oxo-1H-pyridazine-5-carbohydrazide
PubChem CID45122800
Molecular FormulaC5H6N4O2
Molecular Weight154.13 g/mol
Exact Mass154.05
IUPAC Name6-oxo-1H-pyridazine-5-carbohydrazide
SMILESNNC(=O)c1ccn[nH]c1=O
InChIInChI=1S/C5H6N4O2/c6-8-4(10)3-1-2-7-9-5(3)11/h1-2H,6H2,(H,8,10)(H,9,11)
InChIKeyPIJZPMBSSLXALM-UHFFFAOYSA-N
XLogP-1.63
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.13
LogP ≤ 5-1.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(4-fluorophenyl)-6-oxo-1H-pyridazine-5-carboxamide
CID 69229250
6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide
CID 23566951
tert-butyl 6-oxo-1H-pyridazine-5-carboxylate
CID 123317525
2-(1H-pyrazol-5-yl)acetohydrazide
CID 4196186
N-[2-[furan-2-ylmethyl(propan-2-yl)amino]ethyl]-6-oxo-1H-pyridazine-5-carboxamide
CID 166372648
2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide
CID 82521335
2-bromo-N-(6-oxo-1H-pyridazin-5-yl)benzamide
CID 132590615
2-(carbamoylamino)-N-[1-(6-oxo-1H-pyridazine-5-carbonyl)azetidin-3-yl]benzamide
CID 166396922
2,5-dichlorobenzene-1,4-dicarbohydrazide
CID 124926031
5-bromo-1H-pyridazin-6-one
CID 13103616
5-(hydrazinecarbonyl)-N-[1-(1H-pyrazol-5-yl)ethyl]thiophene-2-carboxamide
CID 67087165
1,5-naphthyridine-4-carbohydrazide
CID 174723125

Frequently Asked Questions

What is the IUPAC name of 6-oxo-1H-pyridazine-5-carbohydrazide?
The IUPAC name of 6-oxo-1H-pyridazine-5-carbohydrazide (CID 45122800) is 6-oxo-1H-pyridazine-5-carbohydrazide.
What is the SMILES notation for 6-oxo-1H-pyridazine-5-carbohydrazide?
The canonical SMILES for 6-oxo-1H-pyridazine-5-carbohydrazide is NNC(=O)c1ccn[nH]c1=O.
What is the InChIKey of 6-oxo-1H-pyridazine-5-carbohydrazide?
The InChIKey is PIJZPMBSSLXALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4O2/c6-8-4(10)3-1-2-7-9-5(3)11/h1-2H,6H2,(H,8,10)(H,9,11).
What are the key properties of 6-oxo-1H-pyridazine-5-carbohydrazide?
6-oxo-1H-pyridazine-5-carbohydrazide has a molecular weight of 154.13 g/mol, XLogP of -1.63, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-1H-pyridazine-5-carbohydrazide is sourced from PubChem (CID 45122800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).