1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid

C8H10N2O3 — CID 155822205

IUPAC1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid
SMILESO=C(O)C1=NN(C2CC2)C(=O)CC1
InChIInChI=1S/C8H10N2O3/c11-7-4-3-6(8(12)13)9-10(7)5-1-2-5/h5H,1-4H2,(H,12,13)
InChIKeyUTIZYMBCJTWVBZ-UHFFFAOYSA-N
MW182.18 g/mol
LogP0.21
Rot. Bonds2

About 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid

1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid (PubChem CID 155822205) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid.

Molecular Properties

Compound Name1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid
PubChem CID155822205
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid
SMILESO=C(O)C1=NN(C2CC2)C(=O)CC1
InChIInChI=1S/C8H10N2O3/c11-7-4-3-6(8(12)13)9-10(7)5-1-2-5/h5H,1-4H2,(H,12,13)
InChIKeyUTIZYMBCJTWVBZ-UHFFFAOYSA-N
XLogP0.21
TPSA69.97 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid 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 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid?
The IUPAC name of 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid (CID 155822205) is 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid.
What is the SMILES notation for 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid?
The canonical SMILES for 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid is O=C(O)C1=NN(C2CC2)C(=O)CC1.
What is the InChIKey of 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid?
The InChIKey is UTIZYMBCJTWVBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c11-7-4-3-6(8(12)13)9-10(7)5-1-2-5/h5H,1-4H2,(H,12,13).
What are the key properties of 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid?
1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid has a molecular weight of 182.18 g/mol, XLogP of 0.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-6-oxo-4,5-dihydropyridazine-3-carboxylic acid is sourced from PubChem (CID 155822205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).