1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine

C11H22N2O — CID 166774411

IUPAC1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine
SMILESCC/C=C(\CC)N(N)C1CCCCO1
InChIInChI=1S/C11H22N2O/c1-3-7-10(4-2)13(12)11-8-5-6-9-14-11/h7,11H,3-6,8-9,12H2,1-2H3/b10-7+
InChIKeyASXGUPSBCGDGQB-JXMROGBWSA-N
MW198.31 g/mol
LogP2.39
Rot. Bonds4

About 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine

1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine (PubChem CID 166774411) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine.

Molecular Properties

Compound Name1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine
PubChem CID166774411
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine
SMILESCC/C=C(\CC)N(N)C1CCCCO1
InChIInChI=1S/C11H22N2O/c1-3-7-10(4-2)13(12)11-8-5-6-9-14-11/h7,11H,3-6,8-9,12H2,1-2H3/b10-7+
InChIKeyASXGUPSBCGDGQB-JXMROGBWSA-N
XLogP2.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine?
The IUPAC name of 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine (CID 166774411) is 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine.
What is the SMILES notation for 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine?
The canonical SMILES for 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine is CC/C=C(\CC)N(N)C1CCCCO1.
What is the InChIKey of 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine?
The InChIKey is ASXGUPSBCGDGQB-JXMROGBWSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-7-10(4-2)13(12)11-8-5-6-9-14-11/h7,11H,3-6,8-9,12H2,1-2H3/b10-7+.
What are the key properties of 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine?
1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine has a molecular weight of 198.31 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-hex-3-en-3-yl]-1-(oxan-2-yl)hydrazine is sourced from PubChem (CID 166774411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).