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

C12H24N2O2 — CID 102650160

IUPAC[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine
SMILESCCOC(C)(CC)C(NN)C1=CCCCO1
InChIInChI=1S/C12H24N2O2/c1-4-12(3,16-5-2)11(14-13)10-8-6-7-9-15-10/h8,11,14H,4-7,9,13H2,1-3H3
InChIKeyCBXWWUZULUKYQR-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.72
Rot. Bonds6

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

[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine (PubChem CID 102650160) 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-2-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine
PubChem CID102650160
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine
SMILESCCOC(C)(CC)C(NN)C1=CCCCO1
InChIInChI=1S/C12H24N2O2/c1-4-12(3,16-5-2)11(14-13)10-8-6-7-9-15-10/h8,11,14H,4-7,9,13H2,1-3H3
InChIKeyCBXWWUZULUKYQR-UHFFFAOYSA-N
XLogP1.72
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 ≤ 51.72
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-2-methylbutan-1-amine
CID 102648095
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutan-1-amine
CID 102648099
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-ethylbutan-1-amine
CID 102648102
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethyl-2-methoxybutan-1-amine
CID 102648104
[1-(3,4-dihydro-2H-pyran-6-yl)-3-methylbutyl]hydrazine
CID 102649894
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)-2-propoxyethyl]hydrazine
CID 102649934
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methylbutyl]hydrazine
CID 102649973
[1-(3,4-dihydro-2H-pyran-6-yl)-3,3-dimethylbutyl]hydrazine
CID 102649975
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxypropyl]hydrazine
CID 102649983

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine?
The IUPAC name of [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine (CID 102650160) is [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine.
What is the SMILES notation for [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine?
The canonical SMILES for [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine is CCOC(C)(CC)C(NN)C1=CCCCO1.
What is the InChIKey of [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine?
The InChIKey is CBXWWUZULUKYQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-12(3,16-5-2)11(14-13)10-8-6-7-9-15-10/h8,11,14H,4-7,9,13H2,1-3H3.
What are the key properties of [1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine?
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine has a molecular weight of 228.34 g/mol, XLogP of 1.72, 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-2-methylbutyl]hydrazine is sourced from PubChem (CID 102650160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).