[4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine

C₁₂H₂₆N₂O₂ — CID 103026315

About [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine

[4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine (PubChem CID 103026315) has the molecular formula C₁₂H₂₆N₂O₂ and a molecular weight of 230.35 g/mol. Its IUPAC name is [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine.

Molecular Properties

• Compound Name: [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine
• PubChem CID: 103026315
• Molecular Formula: C₁₂H₂₆N₂O₂
• Molecular Weight: 230.35 g/mol
• Exact Mass: 230.20
• IUPAC Name: [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine
• SMILES: COC(C)(C)CCC(NN)C1CCOCC1
• InChI: InChI=1S/C12H26N2O2/c1-12(2,15-3)7-4-11(14-13)10-5-8-16-9-6-10/h10-11,14H,4-9,13H2,1-3H3
• InChIKey: PMHRWUUUMFNCDG-UHFFFAOYSA-N
• XLogP: 1.45
• TPSA: 56.51 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	230.35
LogP ≤ 5	1.45
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

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 [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine?

The IUPAC name of [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine (CID 103026315) is [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine.

What is the SMILES notation for [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine?

The canonical SMILES for [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine is COC(C)(C)CCC(NN)C1CCOCC1.

What is the InChIKey of [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine?

The InChIKey is PMHRWUUUMFNCDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-12(2,15-3)7-4-11(14-13)10-5-8-16-9-6-10/h10-11,14H,4-9,13H2,1-3H3.

What are the key properties of [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine?

[4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine has a molecular weight of 230.35 g/mol, XLogP of 1.45, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [4-methoxy-4-methyl-1-(oxan-4-yl)pentyl]hydrazine is sourced from PubChem (CID 103026315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 103026315 — identifiers, structure, computed properties (public domain)

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