[1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine

C15H24N2O — CID 105224970

IUPAC[1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine
SMILESCOCCCC(NN)c1ccccc1C1CCC1
InChIInChI=1S/C15H24N2O/c1-18-11-5-10-15(17-16)14-9-3-2-8-13(14)12-6-4-7-12/h2-3,8-9,12,15,17H,4-7,10-11,16H2,1H3
InChIKeyRLFANCNLVSNPRI-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.89
Rot. Bonds7

About [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine

[1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine (PubChem CID 105224970) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine
PubChem CID105224970
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name[1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine
SMILESCOCCCC(NN)c1ccccc1C1CCC1
InChIInChI=1S/C15H24N2O/c1-18-11-5-10-15(17-16)14-9-3-2-8-13(14)12-6-4-7-12/h2-3,8-9,12,15,17H,4-7,10-11,16H2,1H3
InChIKeyRLFANCNLVSNPRI-UHFFFAOYSA-N
XLogP2.89
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine?
The IUPAC name of [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine (CID 105224970) is [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine.
What is the SMILES notation for [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine?
The canonical SMILES for [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine is COCCCC(NN)c1ccccc1C1CCC1.
What is the InChIKey of [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine?
The InChIKey is RLFANCNLVSNPRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-18-11-5-10-15(17-16)14-9-3-2-8-13(14)12-6-4-7-12/h2-3,8-9,12,15,17H,4-7,10-11,16H2,1H3.
What are the key properties of [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine?
[1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine has a molecular weight of 248.37 g/mol, XLogP of 2.89, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-cyclobutylphenyl)-4-methoxybutyl]hydrazine is sourced from PubChem (CID 105224970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).