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

C7H11ClF2N2O — CID 102650132

IUPAC[2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine
SMILESNNC(C1=CCCCO1)C(F)(F)Cl
InChIInChI=1S/C7H11ClF2N2O/c8-7(9,10)6(12-11)5-3-1-2-4-13-5/h3,6,12H,1-2,4,11H2
InChIKeyJYMYLYWBOZBYBO-UHFFFAOYSA-N
MW212.63 g/mol
LogP1.34
Rot. Bonds3

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

[2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine (PubChem CID 102650132) has the molecular formula C7H11ClF2N2O and a molecular weight of 212.63 g/mol. Its IUPAC name is [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine.

Molecular Properties

Compound Name[2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine
PubChem CID102650132
Molecular FormulaC7H11ClF2N2O
Molecular Weight212.63 g/mol
Exact Mass212.05
IUPAC Name[2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine
SMILESNNC(C1=CCCCO1)C(F)(F)Cl
InChIInChI=1S/C7H11ClF2N2O/c8-7(9,10)6(12-11)5-3-1-2-4-13-5/h3,6,12H,1-2,4,11H2
InChIKeyJYMYLYWBOZBYBO-UHFFFAOYSA-N
XLogP1.34
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.63
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'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 [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine?
The IUPAC name of [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine (CID 102650132) is [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine.
What is the SMILES notation for [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine?
The canonical SMILES for [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine is NNC(C1=CCCCO1)C(F)(F)Cl.
What is the InChIKey of [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine?
The InChIKey is JYMYLYWBOZBYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11ClF2N2O/c8-7(9,10)6(12-11)5-3-1-2-4-13-5/h3,6,12H,1-2,4,11H2.
What are the key properties of [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine?
[2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine has a molecular weight of 212.63 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]hydrazine is sourced from PubChem (CID 102650132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).