5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide

C9H10N4O2 — CID 168698480

IUPAC5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ccnnc2)C1
InChIInChI=1S/C9H10N4O2/c10-9(15)6-3-8(14)13(5-6)7-1-2-11-12-4-7/h1-2,4,6H,3,5H2,(H2,10,15)
InChIKeyVGJVFPQQXRTNMR-UHFFFAOYSA-N
MW206.20 g/mol
LogP-0.69
Rot. Bonds2

About 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide

5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide (PubChem CID 168698480) has the molecular formula C9H10N4O2 and a molecular weight of 206.20 g/mol. Its IUPAC name is 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide
PubChem CID168698480
Molecular FormulaC9H10N4O2
Molecular Weight206.20 g/mol
Exact Mass206.08
IUPAC Name5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ccnnc2)C1
InChIInChI=1S/C9H10N4O2/c10-9(15)6-3-8(14)13(5-6)7-1-2-11-12-4-7/h1-2,4,6H,3,5H2,(H2,10,15)
InChIKeyVGJVFPQQXRTNMR-UHFFFAOYSA-N
XLogP-0.69
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 5-0.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-oxo-1-pyridazin-4-ylpyrrolidine-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

Frequently Asked Questions

What is the IUPAC name of 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide?
The IUPAC name of 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide (CID 168698480) is 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide?
The canonical SMILES for 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide is NC(=O)C1CC(=O)N(c2ccnnc2)C1.
What is the InChIKey of 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide?
The InChIKey is VGJVFPQQXRTNMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c10-9(15)6-3-8(14)13(5-6)7-1-2-11-12-4-7/h1-2,4,6H,3,5H2,(H2,10,15).
What are the key properties of 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide?
5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide has a molecular weight of 206.20 g/mol, XLogP of -0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-1-pyridazin-4-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 168698480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).