[6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine

C12H18N6 — CID 3053976

IUPAC[6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine
SMILESCc1nn(-c2ccc(NN)nn2)c(C)c1C(C)C
InChIInChI=1S/C12H18N6/c1-7(2)12-8(3)17-18(9(12)4)11-6-5-10(14-13)15-16-11/h5-7H,13H2,1-4H3,(H,14,15)
InChIKeyMOWPADJNBVZBIQ-UHFFFAOYSA-N
MW246.32 g/mol
LogP1.69
Rot. Bonds3

About [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine

[6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine (PubChem CID 3053976) has the molecular formula C12H18N6 and a molecular weight of 246.32 g/mol. Its IUPAC name is [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine.

Molecular Properties

Compound Name[6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine
PubChem CID3053976
Molecular FormulaC12H18N6
Molecular Weight246.32 g/mol
Exact Mass246.16
IUPAC Name[6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine
SMILESCc1nn(-c2ccc(NN)nn2)c(C)c1C(C)C
InChIInChI=1S/C12H18N6/c1-7(2)12-8(3)17-18(9(12)4)11-6-5-10(14-13)15-16-11/h5-7H,13H2,1-4H3,(H,14,15)
InChIKeyMOWPADJNBVZBIQ-UHFFFAOYSA-N
XLogP1.69
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.32
LogP ≤ 51.69
H-Bond Donors ≤ 52
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-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine?
The IUPAC name of [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine (CID 3053976) is [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine.
What is the SMILES notation for [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine?
The canonical SMILES for [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine is Cc1nn(-c2ccc(NN)nn2)c(C)c1C(C)C.
What is the InChIKey of [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine?
The InChIKey is MOWPADJNBVZBIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6/c1-7(2)12-8(3)17-18(9(12)4)11-6-5-10(14-13)15-16-11/h5-7H,13H2,1-4H3,(H,14,15).
What are the key properties of [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine?
[6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine has a molecular weight of 246.32 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,5-dimethyl-4-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]hydrazine is sourced from PubChem (CID 3053976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).