[1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine

C6H9F3N2O — CID 102654129

IUPAC[1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine
SMILESNNC(C1=CCCO1)C(F)(F)F
InChIInChI=1S/C6H9F3N2O/c7-6(8,9)5(11-10)4-2-1-3-12-4/h2,5,11H,1,3,10H2
InChIKeyCBNSWPCUVJKBIS-UHFFFAOYSA-N
MW182.14 g/mol
LogP0.68
Rot. Bonds2

About [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine

[1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine (PubChem CID 102654129) has the molecular formula C6H9F3N2O and a molecular weight of 182.14 g/mol. Its IUPAC name is [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine
PubChem CID102654129
Molecular FormulaC6H9F3N2O
Molecular Weight182.14 g/mol
Exact Mass182.07
IUPAC Name[1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine
SMILESNNC(C1=CCCO1)C(F)(F)F
InChIInChI=1S/C6H9F3N2O/c7-6(8,9)5(11-10)4-2-1-3-12-4/h2,5,11H,1,3,10H2
InChIKeyCBNSWPCUVJKBIS-UHFFFAOYSA-N
XLogP0.68
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.14
LogP ≤ 50.68
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 [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine?
The IUPAC name of [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine (CID 102654129) is [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine.
What is the SMILES notation for [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine?
The canonical SMILES for [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine is NNC(C1=CCCO1)C(F)(F)F.
What is the InChIKey of [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine?
The InChIKey is CBNSWPCUVJKBIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F3N2O/c7-6(8,9)5(11-10)4-2-1-3-12-4/h2,5,11H,1,3,10H2.
What are the key properties of [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine?
[1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine has a molecular weight of 182.14 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dihydrofuran-5-yl)-2,2,2-trifluoroethyl]hydrazine is sourced from PubChem (CID 102654129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).