1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine

C11H19F3N2 — CID 135215887

IUPAC1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine
SMILESC/C=C(\C=C(\CC(C)C)N(C)N)C(F)(F)F
InChIInChI=1S/C11H19F3N2/c1-5-9(11(12,13)14)7-10(16(4)15)6-8(2)3/h5,7-8H,6,15H2,1-4H3/b9-5+,10-7-
InChIKeyJSPUPGGAWIVWJR-WMARFAMYSA-N
MW236.28 g/mol
LogP3.23
Rot. Bonds4

About 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine

1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine (PubChem CID 135215887) has the molecular formula C11H19F3N2 and a molecular weight of 236.28 g/mol. Its IUPAC name is 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine.

Molecular Properties

Compound Name1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine
PubChem CID135215887
Molecular FormulaC11H19F3N2
Molecular Weight236.28 g/mol
Exact Mass236.15
IUPAC Name1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine
SMILESC/C=C(\C=C(\CC(C)C)N(C)N)C(F)(F)F
InChIInChI=1S/C11H19F3N2/c1-5-9(11(12,13)14)7-10(16(4)15)6-8(2)3/h5,7-8H,6,15H2,1-4H3/b9-5+,10-7-
InChIKeyJSPUPGGAWIVWJR-WMARFAMYSA-N
XLogP3.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine?
The IUPAC name of 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine (CID 135215887) is 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine.
What is the SMILES notation for 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine?
The canonical SMILES for 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine is C/C=C(\C=C(\CC(C)C)N(C)N)C(F)(F)F.
What is the InChIKey of 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine?
The InChIKey is JSPUPGGAWIVWJR-WMARFAMYSA-N. The full InChI is InChI=1S/C11H19F3N2/c1-5-9(11(12,13)14)7-10(16(4)15)6-8(2)3/h5,7-8H,6,15H2,1-4H3/b9-5+,10-7-.
What are the key properties of 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine?
1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine has a molecular weight of 236.28 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-[(4Z,6E)-2-methyl-6-(trifluoromethyl)octa-4,6-dien-4-yl]hydrazine is sourced from PubChem (CID 135215887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).