1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine

C10H19FN2 — CID 135190259

IUPAC1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine
SMILESCC/C=C(F)\C(C)=C(/CC)N(C)N
InChIInChI=1S/C10H19FN2/c1-5-7-9(11)8(3)10(6-2)13(4)12/h7H,5-6,12H2,1-4H3/b9-7+,10-8+
InChIKeyOJPZMNWVVQBLKB-FIFLTTCUSA-N
MW186.27 g/mol
LogP2.74
Rot. Bonds4

About 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine

1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine (PubChem CID 135190259) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine.

Molecular Properties

Compound Name1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine
PubChem CID135190259
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine
SMILESCC/C=C(F)\C(C)=C(/CC)N(C)N
InChIInChI=1S/C10H19FN2/c1-5-7-9(11)8(3)10(6-2)13(4)12/h7H,5-6,12H2,1-4H3/b9-7+,10-8+
InChIKeyOJPZMNWVVQBLKB-FIFLTTCUSA-N
XLogP2.74
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 52.74
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-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine?
The IUPAC name of 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine (CID 135190259) is 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine.
What is the SMILES notation for 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine?
The canonical SMILES for 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine is CC/C=C(F)\C(C)=C(/CC)N(C)N.
What is the InChIKey of 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine?
The InChIKey is OJPZMNWVVQBLKB-FIFLTTCUSA-N. The full InChI is InChI=1S/C10H19FN2/c1-5-7-9(11)8(3)10(6-2)13(4)12/h7H,5-6,12H2,1-4H3/b9-7+,10-8+.
What are the key properties of 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine?
1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine has a molecular weight of 186.27 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3E,5E)-5-fluoro-4-methylocta-3,5-dien-3-yl]-1-methylhydrazine is sourced from PubChem (CID 135190259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).