[1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine

C9H15F3N2O — CID 105248892

IUPAC[1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine
SMILESNNC(CCC(F)(F)F)C1=COCCC1
InChIInChI=1S/C9H15F3N2O/c10-9(11,12)4-3-8(14-13)7-2-1-5-15-6-7/h6,8,14H,1-5,13H2
InChIKeyYFASNXYBGSWBCB-UHFFFAOYSA-N
MW224.23 g/mol
LogP1.86
Rot. Bonds4

About [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine

[1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine (PubChem CID 105248892) has the molecular formula C9H15F3N2O and a molecular weight of 224.23 g/mol. Its IUPAC name is [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine
PubChem CID105248892
Molecular FormulaC9H15F3N2O
Molecular Weight224.23 g/mol
Exact Mass224.11
IUPAC Name[1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine
SMILESNNC(CCC(F)(F)F)C1=COCCC1
InChIInChI=1S/C9H15F3N2O/c10-9(11,12)4-3-8(14-13)7-2-1-5-15-6-7/h6,8,14H,1-5,13H2
InChIKeyYFASNXYBGSWBCB-UHFFFAOYSA-N
XLogP1.86
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.23
LogP ≤ 51.86
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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Related Compounds

[1-(3,4-dihydro-2H-pyran-5-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151719
[3-(2,2-difluoroethoxy)-1-(3,4-dihydro-2H-pyran-5-yl)propyl]hydrazine
CID 103152058
[1-(3,4-dihydro-2H-pyran-5-yl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217748
[1-(3,4-dihydro-2H-pyran-5-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propyl]hydrazine
CID 103312900
[1-(3,4-dihydro-2H-pyran-5-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethyl]hydrazine
CID 103477849
1-(3,4-dihydro-2H-pyran-5-yl)-3,3,3-trifluoropropan-1-amine
CID 104058657
1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutan-1-amine
CID 104059226
[1-(3,4-dihydro-2H-pyran-5-yl)-3,3,3-trifluoropropyl]hydrazine
CID 105205875
[1-(3,4-dihydro-2H-pyran-5-yl)-2,2,2-trifluoroethyl]hydrazine
CID 105215579
[1-(3,4-dihydro-2H-pyran-5-yl)-2,2-difluoroethyl]hydrazine
CID 105264984
[2-chloro-1-(3,4-dihydro-2H-pyran-5-yl)-2,2-difluoroethyl]hydrazine
CID 105265339
[3,4-dihydro-2H-pyran-5-yl-[3-(trifluoromethyl)cyclohexyl]methyl]hydrazine
CID 105333211

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine?
The IUPAC name of [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine (CID 105248892) is [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine.
What is the SMILES notation for [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine?
The canonical SMILES for [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine is NNC(CCC(F)(F)F)C1=COCCC1.
What is the InChIKey of [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine?
The InChIKey is YFASNXYBGSWBCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N2O/c10-9(11,12)4-3-8(14-13)7-2-1-5-15-6-7/h6,8,14H,1-5,13H2.
What are the key properties of [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine?
[1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine has a molecular weight of 224.23 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dihydro-2H-pyran-5-yl)-4,4,4-trifluorobutyl]hydrazine is sourced from PubChem (CID 105248892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).