2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene

C9H8F4N2O2S — CID 72706593

IUPAC2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene
SMILESNS(=O)(=O)NC1c2c(ccc(F)c2F)CC1(F)F
InChIInChI=1S/C9H8F4N2O2S/c10-5-2-1-4-3-9(12,13)8(6(4)7(5)11)15-18(14,16)17/h1-2,8,15H,3H2,(H2,14,16,17)
InChIKeyXWZLWEHPDXMBQC-UHFFFAOYSA-N
MW284.23 g/mol
LogP0.99
Rot. Bonds2

About 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene

2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene (PubChem CID 72706593) has the molecular formula C9H8F4N2O2S and a molecular weight of 284.23 g/mol. Its IUPAC name is 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene.

Molecular Properties

Compound Name2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene
PubChem CID72706593
Molecular FormulaC9H8F4N2O2S
Molecular Weight284.23 g/mol
Exact Mass284.02
IUPAC Name2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene
SMILESNS(=O)(=O)NC1c2c(ccc(F)c2F)CC1(F)F
InChIInChI=1S/C9H8F4N2O2S/c10-5-2-1-4-3-9(12,13)8(6(4)7(5)11)15-18(14,16)17/h1-2,8,15H,3H2,(H2,14,16,17)
InChIKeyXWZLWEHPDXMBQC-UHFFFAOYSA-N
XLogP0.99
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.23
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene?
The IUPAC name of 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene (CID 72706593) is 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene.
What is the SMILES notation for 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene?
The canonical SMILES for 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene is NS(=O)(=O)NC1c2c(ccc(F)c2F)CC1(F)F.
What is the InChIKey of 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene?
The InChIKey is XWZLWEHPDXMBQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F4N2O2S/c10-5-2-1-4-3-9(12,13)8(6(4)7(5)11)15-18(14,16)17/h1-2,8,15H,3H2,(H2,14,16,17).
What are the key properties of 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene?
2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene has a molecular weight of 284.23 g/mol, XLogP of 0.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,7-tetrafluoro-1-(sulfamoylamino)-1,3-dihydroindene is sourced from PubChem (CID 72706593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).