[1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine

C15H26N2O — CID 106793869

IUPAC[1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine
SMILESCCCC(C)CC(NN)c1ccc(C)cc1OC
InChIInChI=1S/C15H26N2O/c1-5-6-11(2)9-14(17-16)13-8-7-12(3)10-15(13)18-4/h7-8,10-11,14,17H,5-6,9,16H2,1-4H3
InChIKeyUEJPZQYQEYLUFG-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.33
Rot. Bonds7

About [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine

[1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine (PubChem CID 106793869) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine.

Molecular Properties

Compound Name[1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine
PubChem CID106793869
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name[1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine
SMILESCCCC(C)CC(NN)c1ccc(C)cc1OC
InChIInChI=1S/C15H26N2O/c1-5-6-11(2)9-14(17-16)13-8-7-12(3)10-15(13)18-4/h7-8,10-11,14,17H,5-6,9,16H2,1-4H3
InChIKeyUEJPZQYQEYLUFG-UHFFFAOYSA-N
XLogP3.33
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine?
The IUPAC name of [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine (CID 106793869) is [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine.
What is the SMILES notation for [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine?
The canonical SMILES for [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine is CCCC(C)CC(NN)c1ccc(C)cc1OC.
What is the InChIKey of [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine?
The InChIKey is UEJPZQYQEYLUFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-5-6-11(2)9-14(17-16)13-8-7-12(3)10-15(13)18-4/h7-8,10-11,14,17H,5-6,9,16H2,1-4H3.
What are the key properties of [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine?
[1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine has a molecular weight of 250.39 g/mol, XLogP of 3.33, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxy-4-methylphenyl)-3-methylhexyl]hydrazine is sourced from PubChem (CID 106793869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).