[1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine

C13H19FN2 — CID 105198284

IUPAC[1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine
SMILESC=C(C)CCC(Cc1ccc(F)cc1)NN
InChIInChI=1S/C13H19FN2/c1-10(2)3-8-13(16-15)9-11-4-6-12(14)7-5-11/h4-7,13,16H,1,3,8-9,15H2,2H3
InChIKeyQOWYBMKNSWYSDX-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.56
Rot. Bonds6

About [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine

[1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine (PubChem CID 105198284) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine
PubChem CID105198284
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name[1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine
SMILESC=C(C)CCC(Cc1ccc(F)cc1)NN
InChIInChI=1S/C13H19FN2/c1-10(2)3-8-13(16-15)9-11-4-6-12(14)7-5-11/h4-7,13,16H,1,3,8-9,15H2,2H3
InChIKeyQOWYBMKNSWYSDX-UHFFFAOYSA-N
XLogP2.56
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine?
The IUPAC name of [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine (CID 105198284) is [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine.
What is the SMILES notation for [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine?
The canonical SMILES for [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine is C=C(C)CCC(Cc1ccc(F)cc1)NN.
What is the InChIKey of [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine?
The InChIKey is QOWYBMKNSWYSDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c1-10(2)3-8-13(16-15)9-11-4-6-12(14)7-5-11/h4-7,13,16H,1,3,8-9,15H2,2H3.
What are the key properties of [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine?
[1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine has a molecular weight of 222.31 g/mol, XLogP of 2.56, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorophenyl)-5-methylhex-5-en-2-yl]hydrazine is sourced from PubChem (CID 105198284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).