4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid

C10H13N3O3 — CID 155212598

IUPAC4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid
SMILESO=C(O)c1nnccc1N1CCC(O)CC1
InChIInChI=1S/C10H13N3O3/c14-7-2-5-13(6-3-7)8-1-4-11-12-9(8)10(15)16/h1,4,7,14H,2-3,5-6H2,(H,15,16)
InChIKeyUCCCGRWBUUUKLE-UHFFFAOYSA-N
MW223.23 g/mol
LogP0.14
Rot. Bonds2

About 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid

4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid (PubChem CID 155212598) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid.

Molecular Properties

Compound Name4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid
PubChem CID155212598
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid
SMILESO=C(O)c1nnccc1N1CCC(O)CC1
InChIInChI=1S/C10H13N3O3/c14-7-2-5-13(6-3-7)8-1-4-11-12-9(8)10(15)16/h1,4,7,14H,2-3,5-6H2,(H,15,16)
InChIKeyUCCCGRWBUUUKLE-UHFFFAOYSA-N
XLogP0.14
TPSA86.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(4-hydroxypiperidin-1-yl)pyridazine-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 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid?
The IUPAC name of 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid (CID 155212598) is 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid.
What is the SMILES notation for 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid?
The canonical SMILES for 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid is O=C(O)c1nnccc1N1CCC(O)CC1.
What is the InChIKey of 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid?
The InChIKey is UCCCGRWBUUUKLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c14-7-2-5-13(6-3-7)8-1-4-11-12-9(8)10(15)16/h1,4,7,14H,2-3,5-6H2,(H,15,16).
What are the key properties of 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid?
4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid has a molecular weight of 223.23 g/mol, XLogP of 0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxypiperidin-1-yl)pyridazine-3-carboxylic acid is sourced from PubChem (CID 155212598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).