[2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine

C10H17ClF2N2O2 — CID 105265662

IUPAC[2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine
SMILESNNC(C1CCOC2(CCOC2)C1)C(F)(F)Cl
InChIInChI=1S/C10H17ClF2N2O2/c11-10(12,13)8(15-14)7-1-3-17-9(5-7)2-4-16-6-9/h7-8,15H,1-6,14H2
InChIKeyLJWRROXPWLNDAG-UHFFFAOYSA-N
MW270.71 g/mol
LogP1.24
Rot. Bonds3

About [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine

[2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine (PubChem CID 105265662) has the molecular formula C10H17ClF2N2O2 and a molecular weight of 270.71 g/mol. Its IUPAC name is [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine.

Molecular Properties

Compound Name[2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine
PubChem CID105265662
Molecular FormulaC10H17ClF2N2O2
Molecular Weight270.71 g/mol
Exact Mass270.09
IUPAC Name[2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine
SMILESNNC(C1CCOC2(CCOC2)C1)C(F)(F)Cl
InChIInChI=1S/C10H17ClF2N2O2/c11-10(12,13)8(15-14)7-1-3-17-9(5-7)2-4-16-6-9/h7-8,15H,1-6,14H2
InChIKeyLJWRROXPWLNDAG-UHFFFAOYSA-N
XLogP1.24
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.71
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine?
The IUPAC name of [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine (CID 105265662) is [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine.
What is the SMILES notation for [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine?
The canonical SMILES for [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine is NNC(C1CCOC2(CCOC2)C1)C(F)(F)Cl.
What is the InChIKey of [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine?
The InChIKey is LJWRROXPWLNDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClF2N2O2/c11-10(12,13)8(15-14)7-1-3-17-9(5-7)2-4-16-6-9/h7-8,15H,1-6,14H2.
What are the key properties of [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine?
[2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine has a molecular weight of 270.71 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-1-(2,6-dioxaspiro[4.5]decan-9-yl)-2,2-difluoroethyl]hydrazine is sourced from PubChem (CID 105265662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).