[1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine

C11H22N2O2 — CID 105276713

IUPAC[1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine
SMILESCOC1(C(C=C(C)C)NN)CCOCC1
InChIInChI=1S/C11H22N2O2/c1-9(2)8-10(13-12)11(14-3)4-6-15-7-5-11/h8,10,13H,4-7,12H2,1-3H3
InChIKeyDFNKDEALTWAYFX-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.98
Rot. Bonds4

About [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine

[1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine (PubChem CID 105276713) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine.

Molecular Properties

Compound Name[1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine
PubChem CID105276713
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name[1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine
SMILESCOC1(C(C=C(C)C)NN)CCOCC1
InChIInChI=1S/C11H22N2O2/c1-9(2)8-10(13-12)11(14-3)4-6-15-7-5-11/h8,10,13H,4-7,12H2,1-3H3
InChIKeyDFNKDEALTWAYFX-UHFFFAOYSA-N
XLogP0.98
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-methylbutyl]hydrazine
CID 102649973
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-2-methylpropyl]hydrazine
CID 102650063
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxybutyl]hydrazine
CID 102650148
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxybutyl]hydrazine
CID 102650149
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-3-methylbutyl]hydrazine
CID 102650152
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutyl]hydrazine
CID 102650153
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylpropyl]hydrazine
CID 102650158
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-2-methylbutyl]hydrazine
CID 102650159
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-methylbutyl]hydrazine
CID 102650160
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-2-ethylbutyl]hydrazine
CID 102650161
[1-(3,4-dihydro-2H-pyran-6-yl)-2-ethyl-2-methoxybutyl]hydrazine
CID 102650162
[3,4-dihydro-2H-pyran-6-yl-(4-methoxyoxan-4-yl)methyl]hydrazine
CID 102650166

Frequently Asked Questions

What is the IUPAC name of [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine?
The IUPAC name of [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine (CID 105276713) is [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine.
What is the SMILES notation for [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine?
The canonical SMILES for [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine is COC1(C(C=C(C)C)NN)CCOCC1.
What is the InChIKey of [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine?
The InChIKey is DFNKDEALTWAYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(2)8-10(13-12)11(14-3)4-6-15-7-5-11/h8,10,13H,4-7,12H2,1-3H3.
What are the key properties of [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine?
[1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine has a molecular weight of 214.31 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methoxyoxan-4-yl)-3-methylbut-2-enyl]hydrazine is sourced from PubChem (CID 105276713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).