[1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine

C₁₇H₂₁FN₂ — CID 105203971

About [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine

[1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine (PubChem CID 105203971) has the molecular formula C₁₇H₂₁FN₂ and a molecular weight of 272.37 g/mol. Its IUPAC name is [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine.

Molecular Properties

• Compound Name: [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine
• PubChem CID: 105203971
• Molecular Formula: C₁₇H₂₁FN₂
• Molecular Weight: 272.37 g/mol
• Exact Mass: 272.17
• IUPAC Name: [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine
• SMILES: Cc1cc(C(CCCc2ccccc2)NN)ccc1F
• InChI: InChI=1S/C17H21FN2/c1-13-12-15(10-11-16(13)18)17(20-19)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,10-12,17,20H,5,8-9,19H2,1H3
• InChIKey: YANVJBHGNQIQLE-UHFFFAOYSA-N
• XLogP: 3.66
• TPSA: 38.05 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 2
• Rotatable Bonds: 6
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	272.37
LogP ≤ 5	3.66
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine?

The IUPAC name of [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine (CID 105203971) is [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine.

What is the SMILES notation for [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine?

The canonical SMILES for [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine is Cc1cc(C(CCCc2ccccc2)NN)ccc1F.

What is the InChIKey of [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine?

The InChIKey is YANVJBHGNQIQLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2/c1-13-12-15(10-11-16(13)18)17(20-19)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,10-12,17,20H,5,8-9,19H2,1H3.

What are the key properties of [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine?

[1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine has a molecular weight of 272.37 g/mol, XLogP of 3.66, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for [1-(4-fluoro-3-methylphenyl)-4-phenylbutyl]hydrazine is sourced from PubChem (CID 105203971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 105203971 — identifiers, structure, computed properties (public domain)

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