[1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine

C9H18N4O — CID 105264789

IUPAC[1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine
SMILESCC(C)OCC(NN)c1cncn1C
InChIInChI=1S/C9H18N4O/c1-7(2)14-5-8(12-10)9-4-11-6-13(9)3/h4,6-8,12H,5,10H2,1-3H3
InChIKeyUPUVIXFPHXXQQQ-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.35
Rot. Bonds5

About [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine

[1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine (PubChem CID 105264789) has the molecular formula C9H18N4O and a molecular weight of 198.27 g/mol. Its IUPAC name is [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine
PubChem CID105264789
Molecular FormulaC9H18N4O
Molecular Weight198.27 g/mol
Exact Mass198.15
IUPAC Name[1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine
SMILESCC(C)OCC(NN)c1cncn1C
InChIInChI=1S/C9H18N4O/c1-7(2)14-5-8(12-10)9-4-11-6-13(9)3/h4,6-8,12H,5,10H2,1-3H3
InChIKeyUPUVIXFPHXXQQQ-UHFFFAOYSA-N
XLogP0.35
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine?
The IUPAC name of [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine (CID 105264789) is [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine.
What is the SMILES notation for [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine?
The canonical SMILES for [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine is CC(C)OCC(NN)c1cncn1C.
What is the InChIKey of [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine?
The InChIKey is UPUVIXFPHXXQQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O/c1-7(2)14-5-8(12-10)9-4-11-6-13(9)3/h4,6-8,12H,5,10H2,1-3H3.
What are the key properties of [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine?
[1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine has a molecular weight of 198.27 g/mol, XLogP of 0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methylimidazol-4-yl)-2-propan-2-yloxyethyl]hydrazine is sourced from PubChem (CID 105264789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).