[1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine

C7H12F2N2O — CID 102650131

IUPAC[1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine
SMILESNNC(C1=CCCCO1)C(F)F
InChIInChI=1S/C7H12F2N2O/c8-7(9)6(11-10)5-3-1-2-4-12-5/h3,6-7,11H,1-2,4,10H2
InChIKeyCARVQZRWPREGLT-UHFFFAOYSA-N
MW178.18 g/mol
LogP0.78
Rot. Bonds3

About [1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine

[1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine (PubChem CID 102650131) has the molecular formula C7H12F2N2O and a molecular weight of 178.18 g/mol. Its IUPAC name is [1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine
PubChem CID102650131
Molecular FormulaC7H12F2N2O
Molecular Weight178.18 g/mol
Exact Mass178.09
IUPAC Name[1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine
SMILESNNC(C1=CCCCO1)C(F)F
InChIInChI=1S/C7H12F2N2O/c8-7(9)6(11-10)5-3-1-2-4-12-5/h3,6-7,11H,1-2,4,10H2
InChIKeyCARVQZRWPREGLT-UHFFFAOYSA-N
XLogP0.78
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.18
LogP ≤ 50.78
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-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine?
The IUPAC name of [1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine (CID 102650131) is [1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine.
What is the SMILES notation for [1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine?
The canonical SMILES for [1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine is NNC(C1=CCCCO1)C(F)F.
What is the InChIKey of [1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine?
The InChIKey is CARVQZRWPREGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F2N2O/c8-7(9)6(11-10)5-3-1-2-4-12-5/h3,6-7,11H,1-2,4,10H2.
What are the key properties of [1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine?
[1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine has a molecular weight of 178.18 g/mol, XLogP of 0.78, 3 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-6-yl)-2,2-difluoroethyl]hydrazine is sourced from PubChem (CID 102650131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).