1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine

C11H20N2O — CID 163850102

IUPAC1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine
SMILESC=C(/C=C\CC)N(N)C1CCCCO1
InChIInChI=1S/C11H20N2O/c1-3-4-7-10(2)13(12)11-8-5-6-9-14-11/h4,7,11H,2-3,5-6,8-9,12H2,1H3/b7-4-
InChIKeyOTQGRIYLKPPPGL-DAXSKMNVSA-N
MW196.29 g/mol
LogP2.17
Rot. Bonds4

About 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine

1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine (PubChem CID 163850102) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine.

Molecular Properties

Compound Name1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine
PubChem CID163850102
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine
SMILESC=C(/C=C\CC)N(N)C1CCCCO1
InChIInChI=1S/C11H20N2O/c1-3-4-7-10(2)13(12)11-8-5-6-9-14-11/h4,7,11H,2-3,5-6,8-9,12H2,1H3/b7-4-
InChIKeyOTQGRIYLKPPPGL-DAXSKMNVSA-N
XLogP2.17
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.17
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine?
The IUPAC name of 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine (CID 163850102) is 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine.
What is the SMILES notation for 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine?
The canonical SMILES for 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine is C=C(/C=C\CC)N(N)C1CCCCO1.
What is the InChIKey of 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine?
The InChIKey is OTQGRIYLKPPPGL-DAXSKMNVSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-4-7-10(2)13(12)11-8-5-6-9-14-11/h4,7,11H,2-3,5-6,8-9,12H2,1H3/b7-4-.
What are the key properties of 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine?
1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine has a molecular weight of 196.29 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3Z)-hexa-1,3-dien-2-yl]-1-(oxan-2-yl)hydrazine is sourced from PubChem (CID 163850102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).