1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine

C20H34F2N2 — CID 166651536

IUPAC1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine
SMILESC=C(F)CC/C=C(\CF)CN(C(=C)/C=C(/C)C(C)CCC)N(C)C
InChIInChI=1S/C20H34F2N2/c1-8-10-16(2)17(3)13-19(5)24(23(6)7)15-20(14-21)12-9-11-18(4)22/h12-13,16H,4-5,8-11,14-15H2,1-3,6-7H3/b17-13-,20-12+
InChIKeyBALMJLSIJIWYRO-ZXGSVMRESA-N
MW340.50 g/mol
LogP5.82
Rot. Bonds12

About 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine

1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine (PubChem CID 166651536) has the molecular formula C20H34F2N2 and a molecular weight of 340.50 g/mol. Its IUPAC name is 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine.

Molecular Properties

Compound Name1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine
PubChem CID166651536
Molecular FormulaC20H34F2N2
Molecular Weight340.50 g/mol
Exact Mass340.27
IUPAC Name1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine
SMILESC=C(F)CC/C=C(\CF)CN(C(=C)/C=C(/C)C(C)CCC)N(C)C
InChIInChI=1S/C20H34F2N2/c1-8-10-16(2)17(3)13-19(5)24(23(6)7)15-20(14-21)12-9-11-18(4)22/h12-13,16H,4-5,8-11,14-15H2,1-3,6-7H3/b17-13-,20-12+
InChIKeyBALMJLSIJIWYRO-ZXGSVMRESA-N
XLogP5.82
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.50
LogP ≤ 55.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', '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)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine?
The IUPAC name of 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine (CID 166651536) is 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine.
What is the SMILES notation for 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine?
The canonical SMILES for 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine is C=C(F)CC/C=C(\CF)CN(C(=C)/C=C(/C)C(C)CCC)N(C)C.
What is the InChIKey of 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine?
The InChIKey is BALMJLSIJIWYRO-ZXGSVMRESA-N. The full InChI is InChI=1S/C20H34F2N2/c1-8-10-16(2)17(3)13-19(5)24(23(6)7)15-20(14-21)12-9-11-18(4)22/h12-13,16H,4-5,8-11,14-15H2,1-3,6-7H3/b17-13-,20-12+.
What are the key properties of 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine?
1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine has a molecular weight of 340.50 g/mol, XLogP of 5.82, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3Z)-4,5-dimethylocta-1,3-dien-2-yl]-1-[(2Z)-6-fluoro-2-(fluoromethyl)hepta-2,6-dienyl]-2,2-dimethylhydrazine is sourced from PubChem (CID 166651536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).