[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine

C₁₂H₂₆N₂O — CID 107896000

About [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine

[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine (PubChem CID 107896000) has the molecular formula C₁₂H₂₆N₂O and a molecular weight of 214.35 g/mol. Its IUPAC name is [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine.

Molecular Properties

• Compound Name: [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine
• PubChem CID: 107896000
• Molecular Formula: C₁₂H₂₆N₂O
• Molecular Weight: 214.35 g/mol
• Exact Mass: 214.20
• IUPAC Name: [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine
• SMILES: CCCC(C)C(CC1(OC)CCC1)NN
• InChI: InChI=1S/C12H26N2O/c1-4-6-10(2)11(14-13)9-12(15-3)7-5-8-12/h10-11,14H,4-9,13H2,1-3H3
• InChIKey: RFSRLERYYLVQIE-UHFFFAOYSA-N
• XLogP: 2.21
• TPSA: 47.28 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 7
• Heavy Atoms: 15
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	214.35
LogP ≤ 5	2.21
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

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-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine?

The IUPAC name of [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine (CID 107896000) is [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine.

What is the SMILES notation for [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine?

The canonical SMILES for [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine is CCCC(C)C(CC1(OC)CCC1)NN.

What is the InChIKey of [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine?

The InChIKey is RFSRLERYYLVQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-6-10(2)11(14-13)9-12(15-3)7-5-8-12/h10-11,14H,4-9,13H2,1-3H3.

What are the key properties of [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine?

[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine has a molecular weight of 214.35 g/mol, XLogP of 2.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine is sourced from PubChem (CID 107896000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 107896000 — identifiers, structure, computed properties (public domain)

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