[5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine

C10H19F3N2O — CID 105229920

IUPAC[5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine
SMILESNNC(CCCC(F)(F)F)C1CCCOC1
InChIInChI=1S/C10H19F3N2O/c11-10(12,13)5-1-4-9(15-14)8-3-2-6-16-7-8/h8-9,15H,1-7,14H2
InChIKeyFDWUMYCFKCFACN-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.98
Rot. Bonds5

About [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine

[5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine (PubChem CID 105229920) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine.

Molecular Properties

Compound Name[5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine
PubChem CID105229920
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name[5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine
SMILESNNC(CCCC(F)(F)F)C1CCCOC1
InChIInChI=1S/C10H19F3N2O/c11-10(12,13)5-1-4-9(15-14)8-3-2-6-16-7-8/h8-9,15H,1-7,14H2
InChIKeyFDWUMYCFKCFACN-UHFFFAOYSA-N
XLogP1.98
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine?
The IUPAC name of [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine (CID 105229920) is [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine.
What is the SMILES notation for [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine?
The canonical SMILES for [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine is NNC(CCCC(F)(F)F)C1CCCOC1.
What is the InChIKey of [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine?
The InChIKey is FDWUMYCFKCFACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c11-10(12,13)5-1-4-9(15-14)8-3-2-6-16-7-8/h8-9,15H,1-7,14H2.
What are the key properties of [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine?
[5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine has a molecular weight of 240.27 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5,5,5-trifluoro-1-(oxan-3-yl)pentyl]hydrazine is sourced from PubChem (CID 105229920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).