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

C11H20N2O — CID 135137440

IUPAC2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine
SMILESC=C(/C=C\C)N(NC)C1CCCCO1
InChIInChI=1S/C11H20N2O/c1-4-7-10(2)13(12-3)11-8-5-6-9-14-11/h4,7,11-12H,2,5-6,8-9H2,1,3H3/b7-4-
InChIKeyCGULWQRLJXRAFO-DAXSKMNVSA-N
MW196.29 g/mol
LogP2.04
Rot. Bonds4

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

2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine (PubChem CID 135137440) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine.

Molecular Properties

Compound Name2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine
PubChem CID135137440
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine
SMILESC=C(/C=C\C)N(NC)C1CCCCO1
InChIInChI=1S/C11H20N2O/c1-4-7-10(2)13(12-3)11-8-5-6-9-14-11/h4,7,11-12H,2,5-6,8-9H2,1,3H3/b7-4-
InChIKeyCGULWQRLJXRAFO-DAXSKMNVSA-N
XLogP2.04
TPSA24.50 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 ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine?
The IUPAC name of 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine (CID 135137440) is 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine.
What is the SMILES notation for 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine?
The canonical SMILES for 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine is C=C(/C=C\C)N(NC)C1CCCCO1.
What is the InChIKey of 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine?
The InChIKey is CGULWQRLJXRAFO-DAXSKMNVSA-N. The full InChI is InChI=1S/C11H20N2O/c1-4-7-10(2)13(12-3)11-8-5-6-9-14-11/h4,7,11-12H,2,5-6,8-9H2,1,3H3/b7-4-.
What are the key properties of 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine?
2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine has a molecular weight of 196.29 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(oxan-2-yl)-1-[(3Z)-penta-1,3-dien-2-yl]hydrazine is sourced from PubChem (CID 135137440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).