[1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine

C17H28N4 — CID 105288251

IUPAC[1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine
SMILESCCCCC(CC)CC(Cn1cnc2ccccc21)NN
InChIInChI=1S/C17H28N4/c1-3-5-8-14(4-2)11-15(20-18)12-21-13-19-16-9-6-7-10-17(16)21/h6-7,9-10,13-15,20H,3-5,8,11-12,18H2,1-2H3
InChIKeyPDULLLLZLBNKEU-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.47
Rot. Bonds9

About [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine

[1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine (PubChem CID 105288251) has the molecular formula C17H28N4 and a molecular weight of 288.44 g/mol. Its IUPAC name is [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine
PubChem CID105288251
Molecular FormulaC17H28N4
Molecular Weight288.44 g/mol
Exact Mass288.23
IUPAC Name[1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine
SMILESCCCCC(CC)CC(Cn1cnc2ccccc21)NN
InChIInChI=1S/C17H28N4/c1-3-5-8-14(4-2)11-15(20-18)12-21-13-19-16-9-6-7-10-17(16)21/h6-7,9-10,13-15,20H,3-5,8,11-12,18H2,1-2H3
InChIKeyPDULLLLZLBNKEU-UHFFFAOYSA-N
XLogP3.47
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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1-(benzimidazol-1-yl)-4-ethylhexan-2-amine
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[1-(benzimidazol-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
CID 105313825
[1-(benzimidazol-1-yl)-3-(4-methylphenyl)propan-2-yl]hydrazine
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Frequently Asked Questions

What is the IUPAC name of [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine?
The IUPAC name of [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine (CID 105288251) is [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine.
What is the SMILES notation for [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine?
The canonical SMILES for [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine is CCCCC(CC)CC(Cn1cnc2ccccc21)NN.
What is the InChIKey of [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine?
The InChIKey is PDULLLLZLBNKEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4/c1-3-5-8-14(4-2)11-15(20-18)12-21-13-19-16-9-6-7-10-17(16)21/h6-7,9-10,13-15,20H,3-5,8,11-12,18H2,1-2H3.
What are the key properties of [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine?
[1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine has a molecular weight of 288.44 g/mol, XLogP of 3.47, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(benzimidazol-1-yl)-4-ethyloctan-2-yl]hydrazine is sourced from PubChem (CID 105288251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).