1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine

C11H20F2N2 — CID 105311612

IUPAC1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine
SMILESC=CCCC(NN)C1CCC(F)(F)CC1
InChIInChI=1S/C11H20F2N2/c1-2-3-4-10(15-14)9-5-7-11(12,13)8-6-9/h2,9-10,15H,1,3-8,14H2
InChIKeyQXYPENISKJXGQW-UHFFFAOYSA-N
MW218.29 g/mol
LogP2.61
Rot. Bonds5

About 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine

1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine (PubChem CID 105311612) has the molecular formula C11H20F2N2 and a molecular weight of 218.29 g/mol. Its IUPAC name is 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine.

Molecular Properties

Compound Name1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine
PubChem CID105311612
Molecular FormulaC11H20F2N2
Molecular Weight218.29 g/mol
Exact Mass218.16
IUPAC Name1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine
SMILESC=CCCC(NN)C1CCC(F)(F)CC1
InChIInChI=1S/C11H20F2N2/c1-2-3-4-10(15-14)9-5-7-11(12,13)8-6-9/h2,9-10,15H,1,3-8,14H2
InChIKeyQXYPENISKJXGQW-UHFFFAOYSA-N
XLogP2.61
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 52.61
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-(4,4-difluorocyclohexyl)pent-4-enylhydrazine?
The IUPAC name of 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine (CID 105311612) is 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine.
What is the SMILES notation for 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine?
The canonical SMILES for 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine is C=CCCC(NN)C1CCC(F)(F)CC1.
What is the InChIKey of 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine?
The InChIKey is QXYPENISKJXGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2N2/c1-2-3-4-10(15-14)9-5-7-11(12,13)8-6-9/h2,9-10,15H,1,3-8,14H2.
What are the key properties of 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine?
1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine has a molecular weight of 218.29 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-difluorocyclohexyl)pent-4-enylhydrazine is sourced from PubChem (CID 105311612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).