1-(4-ethylphenyl)oct-7-enylhydrazine

C16H26N2 — CID 107012388

IUPAC1-(4-ethylphenyl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1ccc(CC)cc1
InChIInChI=1S/C16H26N2/c1-3-5-6-7-8-9-16(18-17)15-12-10-14(4-2)11-13-15/h3,10-13,16,18H,1,4-9,17H2,2H3
InChIKeyZDECNUYBPRDZPO-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.89
Rot. Bonds9

About 1-(4-ethylphenyl)oct-7-enylhydrazine

1-(4-ethylphenyl)oct-7-enylhydrazine (PubChem CID 107012388) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 1-(4-ethylphenyl)oct-7-enylhydrazine.

Molecular Properties

Compound Name1-(4-ethylphenyl)oct-7-enylhydrazine
PubChem CID107012388
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name1-(4-ethylphenyl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1ccc(CC)cc1
InChIInChI=1S/C16H26N2/c1-3-5-6-7-8-9-16(18-17)15-12-10-14(4-2)11-13-15/h3,10-13,16,18H,1,4-9,17H2,2H3
InChIKeyZDECNUYBPRDZPO-UHFFFAOYSA-N
XLogP3.89
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(4-ethylphenyl)oct-7-enylhydrazine?
The IUPAC name of 1-(4-ethylphenyl)oct-7-enylhydrazine (CID 107012388) is 1-(4-ethylphenyl)oct-7-enylhydrazine.
What is the SMILES notation for 1-(4-ethylphenyl)oct-7-enylhydrazine?
The canonical SMILES for 1-(4-ethylphenyl)oct-7-enylhydrazine is C=CCCCCCC(NN)c1ccc(CC)cc1.
What is the InChIKey of 1-(4-ethylphenyl)oct-7-enylhydrazine?
The InChIKey is ZDECNUYBPRDZPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-5-6-7-8-9-16(18-17)15-12-10-14(4-2)11-13-15/h3,10-13,16,18H,1,4-9,17H2,2H3.
What are the key properties of 1-(4-ethylphenyl)oct-7-enylhydrazine?
1-(4-ethylphenyl)oct-7-enylhydrazine has a molecular weight of 246.40 g/mol, XLogP of 3.89, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)oct-7-enylhydrazine is sourced from PubChem (CID 107012388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).