[4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine

C15H26N2 — CID 105323985

IUPAC[4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine
SMILESCCC(CC)C(CCc1ccccc1C)NN
InChIInChI=1S/C15H26N2/c1-4-13(5-2)15(17-16)11-10-14-9-7-6-8-12(14)3/h6-9,13,15,17H,4-5,10-11,16H2,1-3H3
InChIKeyDBZWKTHBDBZQJD-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.20
Rot. Bonds7

About [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine

[4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine (PubChem CID 105323985) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine.

Molecular Properties

Compound Name[4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine
PubChem CID105323985
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name[4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine
SMILESCCC(CC)C(CCc1ccccc1C)NN
InChIInChI=1S/C15H26N2/c1-4-13(5-2)15(17-16)11-10-14-9-7-6-8-12(14)3/h6-9,13,15,17H,4-5,10-11,16H2,1-3H3
InChIKeyDBZWKTHBDBZQJD-UHFFFAOYSA-N
XLogP3.20
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine?
The IUPAC name of [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine (CID 105323985) is [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine.
What is the SMILES notation for [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine?
The canonical SMILES for [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine is CCC(CC)C(CCc1ccccc1C)NN.
What is the InChIKey of [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine?
The InChIKey is DBZWKTHBDBZQJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-4-13(5-2)15(17-16)11-10-14-9-7-6-8-12(14)3/h6-9,13,15,17H,4-5,10-11,16H2,1-3H3.
What are the key properties of [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine?
[4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine has a molecular weight of 234.39 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine is sourced from PubChem (CID 105323985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).