6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide

C12H20N6O — CID 62249790

IUPAC6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)NCCN2CCCCC2)nn1
InChIInChI=1S/C12H20N6O/c13-15-11-5-4-10(16-17-11)12(19)14-6-9-18-7-2-1-3-8-18/h4-5H,1-3,6-9,13H2,(H,14,19)(H,15,17)
InChIKeyLOLBFAXRXVANNQ-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.02
Rot. Bonds5

About 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide

6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide (PubChem CID 62249790) has the molecular formula C12H20N6O and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide
PubChem CID62249790
Molecular FormulaC12H20N6O
Molecular Weight264.33 g/mol
Exact Mass264.17
IUPAC Name6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)NCCN2CCCCC2)nn1
InChIInChI=1S/C12H20N6O/c13-15-11-5-4-10(16-17-11)12(19)14-6-9-18-7-2-1-3-8-18/h4-5H,1-3,6-9,13H2,(H,14,19)(H,15,17)
InChIKeyLOLBFAXRXVANNQ-UHFFFAOYSA-N
XLogP-0.02
TPSA96.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide (CID 62249790) is 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide is NNc1ccc(C(=O)NCCN2CCCCC2)nn1.
What is the InChIKey of 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide?
The InChIKey is LOLBFAXRXVANNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N6O/c13-15-11-5-4-10(16-17-11)12(19)14-6-9-18-7-2-1-3-8-18/h4-5H,1-3,6-9,13H2,(H,14,19)(H,15,17).
What are the key properties of 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide?
6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of -0.02, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 62249790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).