[(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine

C7H11FN2 — CID 143782158

IUPAC[(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine
SMILESC=C/C(F)=C(/C)C(=C)NN
InChIInChI=1S/C7H11FN2/c1-4-7(8)5(2)6(3)10-9/h4,10H,1,3,9H2,2H3/b7-5+
InChIKeyBJXYQXGTMBCQTJ-FNORWQNLSA-N
MW142.18 g/mol
LogP1.39
Rot. Bonds3

About [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine

[(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine (PubChem CID 143782158) has the molecular formula C7H11FN2 and a molecular weight of 142.18 g/mol. Its IUPAC name is [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine.

Molecular Properties

Compound Name[(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine
PubChem CID143782158
Molecular FormulaC7H11FN2
Molecular Weight142.18 g/mol
Exact Mass142.09
IUPAC Name[(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine
SMILESC=C/C(F)=C(/C)C(=C)NN
InChIInChI=1S/C7H11FN2/c1-4-7(8)5(2)6(3)10-9/h4,10H,1,3,9H2,2H3/b7-5+
InChIKeyBJXYQXGTMBCQTJ-FNORWQNLSA-N
XLogP1.39
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.18
LogP ≤ 51.39
H-Bond Donors ≤ 52
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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Related Compounds

[(3E,5Z)-3-fluoro-4-methylhepta-1,3,5-trien-2-yl]hydrazine
CID 143782177
[(3Z)-3,4-difluorohexa-1,3,5-trien-2-yl]hydrazine
CID 143782184
[(3E,5E)-5-fluorohepta-1,3,5-trien-4-yl]hydrazine
CID 146285260
3-Ethyl-6-fluoro-4-methyl-1,2-dihydropyridazine
CID 146392507
[(3E)-5-fluoro-2-methylhexa-1,3,5-trien-3-yl]hydrazine
CID 156837174
[(3E,5E)-5-fluorohepta-1,3,5-trien-3-yl]hydrazine
CID 167158859
1-methyl-2-[(3E)-3-(trifluoromethyl)penta-1,3-dien-2-yl]hydrazine
CID 169603941
[(3E)-2-fluorohexa-1,3,5-trien-3-yl]hydrazine
CID 157043314
[(2Z)-3-methylpenta-2,4-dien-2-yl]hydrazine
CID 89002606
3,4-Dimethyl-5-methylidene-1,2-dihydropyrazole
CID 141962348
[(3Z)-5-methylhexa-1,3,5-trien-2-yl]hydrazine
CID 142018752
[(3E)-5-methylhexa-1,3,5-trien-3-yl]hydrazine
CID 144061569

Frequently Asked Questions

What is the IUPAC name of [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine?
The IUPAC name of [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine (CID 143782158) is [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine.
What is the SMILES notation for [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine?
The canonical SMILES for [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine is C=C/C(F)=C(/C)C(=C)NN.
What is the InChIKey of [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine?
The InChIKey is BJXYQXGTMBCQTJ-FNORWQNLSA-N. The full InChI is InChI=1S/C7H11FN2/c1-4-7(8)5(2)6(3)10-9/h4,10H,1,3,9H2,2H3/b7-5+.
What are the key properties of [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine?
[(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine has a molecular weight of 142.18 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E)-4-fluoro-3-methylhexa-1,3,5-trien-2-yl]hydrazine is sourced from PubChem (CID 143782158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).