[2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine

C16H24N4 — CID 105330603

IUPAC[2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine
SMILESNNC(Cn1cnc2ccccc21)C1CCCCCC1
InChIInChI=1S/C16H24N4/c17-19-15(13-7-3-1-2-4-8-13)11-20-12-18-14-9-5-6-10-16(14)20/h5-6,9-10,12-13,15,19H,1-4,7-8,11,17H2
InChIKeyDMFJQQAYQYAYLE-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.84
Rot. Bonds4

About [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine

[2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine (PubChem CID 105330603) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine.

Molecular Properties

Compound Name[2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine
PubChem CID105330603
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name[2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine
SMILESNNC(Cn1cnc2ccccc21)C1CCCCCC1
InChIInChI=1S/C16H24N4/c17-19-15(13-7-3-1-2-4-8-13)11-20-12-18-14-9-5-6-10-16(14)20/h5-6,9-10,12-13,15,19H,1-4,7-8,11,17H2
InChIKeyDMFJQQAYQYAYLE-UHFFFAOYSA-N
XLogP2.84
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.84
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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Frequently Asked Questions

What is the IUPAC name of [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine?
The IUPAC name of [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine (CID 105330603) is [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine.
What is the SMILES notation for [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine?
The canonical SMILES for [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine is NNC(Cn1cnc2ccccc21)C1CCCCCC1.
What is the InChIKey of [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine?
The InChIKey is DMFJQQAYQYAYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c17-19-15(13-7-3-1-2-4-8-13)11-20-12-18-14-9-5-6-10-16(14)20/h5-6,9-10,12-13,15,19H,1-4,7-8,11,17H2.
What are the key properties of [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine?
[2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine has a molecular weight of 272.40 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine is sourced from PubChem (CID 105330603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).