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

C17H20N4 — CID 105285825

IUPAC[1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine
SMILESNNC(CCc1ccccc1)Cn1cnc2ccccc21
InChIInChI=1S/C17H20N4/c18-20-15(11-10-14-6-2-1-3-7-14)12-21-13-19-16-8-4-5-9-17(16)21/h1-9,13,15,20H,10-12,18H2
InChIKeyRQNXZBYZLUSBMB-UHFFFAOYSA-N
MW280.38 g/mol
LogP2.50
Rot. Bonds6

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

[1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine (PubChem CID 105285825) has the molecular formula C17H20N4 and a molecular weight of 280.38 g/mol. Its IUPAC name is [1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine
PubChem CID105285825
Molecular FormulaC17H20N4
Molecular Weight280.38 g/mol
Exact Mass280.17
IUPAC Name[1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine
SMILESNNC(CCc1ccccc1)Cn1cnc2ccccc21
InChIInChI=1S/C17H20N4/c18-20-15(11-10-14-6-2-1-3-7-14)12-21-13-19-16-8-4-5-9-17(16)21/h1-9,13,15,20H,10-12,18H2
InChIKeyRQNXZBYZLUSBMB-UHFFFAOYSA-N
XLogP2.50
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 52.50
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)-5-ethylsulfonylpentan-2-yl]hydrazine
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1-(2-phenylethyl)benzimidazole;hydrochloride
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[1-(benzimidazol-1-yl)-3-(1-methylimidazol-2-yl)propan-2-yl]hydrazine
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[1-(benzimidazol-1-yl)-3-ethylpentan-2-yl]hydrazine
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1-(18-phenyloctadecyl)benzimidazole
CID 67925718
[2-(benzimidazol-1-yl)-1-cycloheptylethyl]hydrazine
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methyl 3-(benzimidazol-1-yl)-2-phenylpropanoate
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1-(benzimidazol-1-yl)-4-(1-methylpyrazol-4-yl)butan-2-amine
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Frequently Asked Questions

What is the IUPAC name of [1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine?
The IUPAC name of [1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine (CID 105285825) is [1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine.
What is the SMILES notation for [1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine?
The canonical SMILES for [1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine is NNC(CCc1ccccc1)Cn1cnc2ccccc21.
What is the InChIKey of [1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine?
The InChIKey is RQNXZBYZLUSBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4/c18-20-15(11-10-14-6-2-1-3-7-14)12-21-13-19-16-8-4-5-9-17(16)21/h1-9,13,15,20H,10-12,18H2.
What are the key properties of [1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine?
[1-(benzimidazol-1-yl)-4-phenylbutan-2-yl]hydrazine has a molecular weight of 280.38 g/mol, XLogP of 2.50, 6 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-phenylbutan-2-yl]hydrazine is sourced from PubChem (CID 105285825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).