6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide

C10H11N7O — CID 106897771

IUPAC6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)NCc2cccnn2)nn1
InChIInChI=1S/C10H11N7O/c11-14-9-4-3-8(16-17-9)10(18)12-6-7-2-1-5-13-15-7/h1-5H,6,11H2,(H,12,18)(H,14,17)
InChIKeyFPVOCBLNUIUQBW-UHFFFAOYSA-N
MW245.25 g/mol
LogP-0.52
Rot. Bonds4

About 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide

6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide (PubChem CID 106897771) has the molecular formula C10H11N7O and a molecular weight of 245.25 g/mol. Its IUPAC name is 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide
PubChem CID106897771
Molecular FormulaC10H11N7O
Molecular Weight245.25 g/mol
Exact Mass245.10
IUPAC Name6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)NCc2cccnn2)nn1
InChIInChI=1S/C10H11N7O/c11-14-9-4-3-8(16-17-9)10(18)12-6-7-2-1-5-13-15-7/h1-5H,6,11H2,(H,12,18)(H,14,17)
InChIKeyFPVOCBLNUIUQBW-UHFFFAOYSA-N
XLogP-0.52
TPSA118.71 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide (CID 106897771) is 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide is NNc1ccc(C(=O)NCc2cccnn2)nn1.
What is the InChIKey of 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide?
The InChIKey is FPVOCBLNUIUQBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N7O/c11-14-9-4-3-8(16-17-9)10(18)12-6-7-2-1-5-13-15-7/h1-5H,6,11H2,(H,12,18)(H,14,17).
What are the key properties of 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide?
6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide has a molecular weight of 245.25 g/mol, XLogP of -0.52, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 106897771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).