[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine

C12H24N2O2 — CID 102650153

IUPAC[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine
SMILESCCOC(C(C)C)C(NN)C1=CCCCO1
InChIInChI=1S/C12H24N2O2/c1-4-15-12(9(2)3)11(14-13)10-7-5-6-8-16-10/h7,9,11-12,14H,4-6,8,13H2,1-3H3
InChIKeyAJGFSDXZUWQMDX-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.57
Rot. Bonds6

About [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine

[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine (PubChem CID 102650153) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine
PubChem CID102650153
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine
SMILESCCOC(C(C)C)C(NN)C1=CCCCO1
InChIInChI=1S/C12H24N2O2/c1-4-15-12(9(2)3)11(14-13)10-7-5-6-8-16-10/h7,9,11-12,14H,4-6,8,13H2,1-3H3
InChIKeyAJGFSDXZUWQMDX-UHFFFAOYSA-N
XLogP1.57
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.57
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

1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-3-methylbutan-1-amine
CID 102648070
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutan-1-amine
CID 102648074
1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-3,3-dimethylbutan-1-amine
CID 102648084
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3,3-dimethylbutan-1-amine
CID 102648087
[1-(3,4-dihydro-2H-pyran-6-yl)-3-methylbutyl]hydrazine
CID 102649894
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methylpropyl]hydrazine
CID 102649896
1-(3,4-dihydro-2H-pyran-6-yl)butylhydrazine
CID 102649905
[cyclopropyl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102649906
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxyethyl]hydrazine
CID 102649924
[1-(3,4-dihydro-2H-pyran-6-yl)-4-methylpentyl]hydrazine
CID 102649925
[1-(3,4-dihydro-2H-pyran-6-yl)-2-propoxyethyl]hydrazine
CID 102649934
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methylbutyl]hydrazine
CID 102649973

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine?
The IUPAC name of [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine (CID 102650153) is [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine is CCOC(C(C)C)C(NN)C1=CCCCO1.
What is the InChIKey of [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine?
The InChIKey is AJGFSDXZUWQMDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-15-12(9(2)3)11(14-13)10-7-5-6-8-16-10/h7,9,11-12,14H,4-6,8,13H2,1-3H3.
What are the key properties of [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine?
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine has a molecular weight of 228.34 g/mol, XLogP of 1.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine is sourced from PubChem (CID 102650153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).