pyrrolidine-1-sulfonyl fluoride

C4H8FNO2S — CID 56965517

IUPACpyrrolidine-1-sulfonyl fluoride
SMILESO=S(=O)(F)N1CCCC1
InChIInChI=1S/C4H8FNO2S/c5-9(7,8)6-3-1-2-4-6/h1-4H2
InChIKeyNLCATURTOHFMNH-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.30
Rot. Bonds1

About pyrrolidine-1-sulfonyl fluoride

pyrrolidine-1-sulfonyl fluoride (PubChem CID 56965517) has the molecular formula C4H8FNO2S and a molecular weight of 153.18 g/mol. Its IUPAC name is pyrrolidine-1-sulfonyl fluoride.

Molecular Properties

Compound Namepyrrolidine-1-sulfonyl fluoride
PubChem CID56965517
Molecular FormulaC4H8FNO2S
Molecular Weight153.18 g/mol
Exact Mass153.03
IUPAC Namepyrrolidine-1-sulfonyl fluoride
SMILESO=S(=O)(F)N1CCCC1
InChIInChI=1S/C4H8FNO2S/c5-9(7,8)6-3-1-2-4-6/h1-4H2
InChIKeyNLCATURTOHFMNH-UHFFFAOYSA-N
XLogP0.30
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Pyrrolidinesulfonyl chloride
CID 6483902
Pyrrolidine-1-sulfonamide
CID 15707376
Sulfopyrrolidine
CID 21963976
3-Fluoropyrrolidine-1-sulfonyl chloride
CID 75530150
(3R)-3-Fluoropyrrolidine-1-sulfonyl chloride
CID 97960733
(S)-3-Fluoropyrrolidine-1-sulfonyl chloride
CID 97960734
2-Fluoropyrrolidine-1-sulfonamide
CID 117720742
2-Fluoropyrrolidine-1-sulfonyl chloride
CID 122700641
3-Fluoropyrrolidine-1-sulfonamide
CID 126742889
(3R)-3-fluoropyrrolidine-1-sulfonyl iodide
CID 135173518
Pyrrolidin-1-yl thiohypofluorite
CID 142890178
(2R)-2-fluoropyrrolidine-1-sulfonyl chloride
CID 152420246

Frequently Asked Questions

What is the IUPAC name of pyrrolidine-1-sulfonyl fluoride?
The IUPAC name of pyrrolidine-1-sulfonyl fluoride (CID 56965517) is pyrrolidine-1-sulfonyl fluoride.
What is the SMILES notation for pyrrolidine-1-sulfonyl fluoride?
The canonical SMILES for pyrrolidine-1-sulfonyl fluoride is O=S(=O)(F)N1CCCC1.
What is the InChIKey of pyrrolidine-1-sulfonyl fluoride?
The InChIKey is NLCATURTOHFMNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO2S/c5-9(7,8)6-3-1-2-4-6/h1-4H2.
What are the key properties of pyrrolidine-1-sulfonyl fluoride?
pyrrolidine-1-sulfonyl fluoride has a molecular weight of 153.18 g/mol, XLogP of 0.30, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolidine-1-sulfonyl fluoride is sourced from PubChem (CID 56965517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).