6-oxo-3H-pyridazine-3-carboxamide

C5H5N3O2 — CID 71628596

IUPAC6-oxo-3H-pyridazine-3-carboxamide
SMILESNC(=O)C1C=CC(=O)N=N1
InChIInChI=1S/C5H5N3O2/c6-5(10)3-1-2-4(9)8-7-3/h1-3H,(H2,6,10)
InChIKeyNYASYPIVBUQIAX-UHFFFAOYSA-N
MW139.11 g/mol
LogP-0.61
Rot. Bonds1

About 6-oxo-3H-pyridazine-3-carboxamide

6-oxo-3H-pyridazine-3-carboxamide (PubChem CID 71628596) has the molecular formula C5H5N3O2 and a molecular weight of 139.11 g/mol. Its IUPAC name is 6-oxo-3H-pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-3H-pyridazine-3-carboxamide
PubChem CID71628596
Molecular FormulaC5H5N3O2
Molecular Weight139.11 g/mol
Exact Mass139.04
IUPAC Name6-oxo-3H-pyridazine-3-carboxamide
SMILESNC(=O)C1C=CC(=O)N=N1
InChIInChI=1S/C5H5N3O2/c6-5(10)3-1-2-4(9)8-7-3/h1-3H,(H2,6,10)
InChIKeyNYASYPIVBUQIAX-UHFFFAOYSA-N
XLogP-0.61
TPSA84.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.11
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-oxo-3H-pyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-bromo-3H-pyridazin-6-one
CID 78174474
3-pyridin-4-yl-3H-pyridazin-6-one
CID 24870137
hydrazine;pyrazol-3-one
CID 158240948
4-amino-2,6-dioxo-3H-pyridine-3-carboxamide
CID 73183367
4-methyl-2-oxo-6-(trifluoromethyl)-3H-pyridine-3-carboxamide
CID 72726621
2-chloro-3,8a-dihydro-2H-chromene-3-carboxamide
CID 164730995
3,6-dioxocyclohexa-1,4-diene-1-carboxamide
CID 23341318
(4S,5R)-2-phenyl-1,3-dioxolane-4,5-dicarboxamide
CID 774799
(2,5-dioxopyrrol-1-yl) 4-amino-4-oxobut-2-enoate
CID 57069463
6-oxo-4-(trifluoromethyl)-2,3-dihydro-1H-pyridine-3-carboxamide
CID 151162309
2,5-dimethylcyclopenta-2,4-diene-1-carboxamide
CID 101214763
2,2-bis(4-methylphenyl)propanediamide
CID 174721937

Frequently Asked Questions

What is the IUPAC name of 6-oxo-3H-pyridazine-3-carboxamide?
The IUPAC name of 6-oxo-3H-pyridazine-3-carboxamide (CID 71628596) is 6-oxo-3H-pyridazine-3-carboxamide.
What is the SMILES notation for 6-oxo-3H-pyridazine-3-carboxamide?
The canonical SMILES for 6-oxo-3H-pyridazine-3-carboxamide is NC(=O)C1C=CC(=O)N=N1.
What is the InChIKey of 6-oxo-3H-pyridazine-3-carboxamide?
The InChIKey is NYASYPIVBUQIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N3O2/c6-5(10)3-1-2-4(9)8-7-3/h1-3H,(H2,6,10).
What are the key properties of 6-oxo-3H-pyridazine-3-carboxamide?
6-oxo-3H-pyridazine-3-carboxamide has a molecular weight of 139.11 g/mol, XLogP of -0.61, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-3H-pyridazine-3-carboxamide is sourced from PubChem (CID 71628596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).