1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane

C4H10F2N2O3S — CID 103081900

IUPAC1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane
SMILESNS(=O)(=O)NCCOCC(F)F
InChIInChI=1S/C4H10F2N2O3S/c5-4(6)3-11-2-1-8-12(7,9)10/h4,8H,1-3H2,(H2,7,9,10)
InChIKeyRBSNTDDMWWJNBS-UHFFFAOYSA-N
MW204.20 g/mol
LogP-0.94
Rot. Bonds6

About 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane

1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane (PubChem CID 103081900) has the molecular formula C4H10F2N2O3S and a molecular weight of 204.20 g/mol. Its IUPAC name is 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane.

Molecular Properties

Compound Name1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane
PubChem CID103081900
Molecular FormulaC4H10F2N2O3S
Molecular Weight204.20 g/mol
Exact Mass204.04
IUPAC Name1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane
SMILESNS(=O)(=O)NCCOCC(F)F
InChIInChI=1S/C4H10F2N2O3S/c5-4(6)3-11-2-1-8-12(7,9)10/h4,8H,1-3H2,(H2,7,9,10)
InChIKeyRBSNTDDMWWJNBS-UHFFFAOYSA-N
XLogP-0.94
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 5-0.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane?
The IUPAC name of 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane (CID 103081900) is 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane.
What is the SMILES notation for 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane?
The canonical SMILES for 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane is NS(=O)(=O)NCCOCC(F)F.
What is the InChIKey of 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane?
The InChIKey is RBSNTDDMWWJNBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10F2N2O3S/c5-4(6)3-11-2-1-8-12(7,9)10/h4,8H,1-3H2,(H2,7,9,10).
What are the key properties of 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane?
1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane has a molecular weight of 204.20 g/mol, XLogP of -0.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-2-[2-(sulfamoylamino)ethoxy]ethane is sourced from PubChem (CID 103081900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).