5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one

C7H12F2N2O2 — CID 106492839

IUPAC5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one
SMILESCN(C)NCC1CC(F)(F)C(=O)O1
InChIInChI=1S/C7H12F2N2O2/c1-11(2)10-4-5-3-7(8,9)6(12)13-5/h5,10H,3-4H2,1-2H3
InChIKeyYTEYACMONJQGRU-UHFFFAOYSA-N
MW194.18 g/mol
LogP0.00
Rot. Bonds3

About 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one

5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one (PubChem CID 106492839) has the molecular formula C7H12F2N2O2 and a molecular weight of 194.18 g/mol. Its IUPAC name is 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one.

Molecular Properties

Compound Name5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one
PubChem CID106492839
Molecular FormulaC7H12F2N2O2
Molecular Weight194.18 g/mol
Exact Mass194.09
IUPAC Name5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one
SMILESCN(C)NCC1CC(F)(F)C(=O)O1
InChIInChI=1S/C7H12F2N2O2/c1-11(2)10-4-5-3-7(8,9)6(12)13-5/h5,10H,3-4H2,1-2H3
InChIKeyYTEYACMONJQGRU-UHFFFAOYSA-N
XLogP0.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.18
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one?
The IUPAC name of 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one (CID 106492839) is 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one.
What is the SMILES notation for 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one?
The canonical SMILES for 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one is CN(C)NCC1CC(F)(F)C(=O)O1.
What is the InChIKey of 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one?
The InChIKey is YTEYACMONJQGRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F2N2O2/c1-11(2)10-4-5-3-7(8,9)6(12)13-5/h5,10H,3-4H2,1-2H3.
What are the key properties of 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one?
5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one has a molecular weight of 194.18 g/mol, XLogP of 0.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,2-dimethylhydrazinyl)methyl]-3,3-difluorooxolan-2-one is sourced from PubChem (CID 106492839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).