[1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine

C11H18N4O — CID 103375492

IUPAC[1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)c1ccc(OC)nn1
InChIInChI=1S/C11H18N4O/c1-8(2)4-5-9(13-12)10-6-7-11(16-3)15-14-10/h6-7,9,13H,1,4-5,12H2,2-3H3
InChIKeyDCGFDCVARRMCDN-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.35
Rot. Bonds6

About [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine

[1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine (PubChem CID 103375492) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine.

Molecular Properties

Compound Name[1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine
PubChem CID103375492
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name[1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)c1ccc(OC)nn1
InChIInChI=1S/C11H18N4O/c1-8(2)4-5-9(13-12)10-6-7-11(16-3)15-14-10/h6-7,9,13H,1,4-5,12H2,2-3H3
InChIKeyDCGFDCVARRMCDN-UHFFFAOYSA-N
XLogP1.35
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine?
The IUPAC name of [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine (CID 103375492) is [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine.
What is the SMILES notation for [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine?
The canonical SMILES for [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine is C=C(C)CCC(NN)c1ccc(OC)nn1.
What is the InChIKey of [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine?
The InChIKey is DCGFDCVARRMCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8(2)4-5-9(13-12)10-6-7-11(16-3)15-14-10/h6-7,9,13H,1,4-5,12H2,2-3H3.
What are the key properties of [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine?
[1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine has a molecular weight of 222.29 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-methoxypyridazin-3-yl)-4-methylpent-4-enyl]hydrazine is sourced from PubChem (CID 103375492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).