4-(2-fluoroethylsulfonyl)piperidine

C7H14FNO2S — CID 84666246

IUPAC4-(2-fluoroethylsulfonyl)piperidine
SMILESO=S(=O)(CCF)C1CCNCC1
InChIInChI=1S/C7H14FNO2S/c8-3-6-12(10,11)7-1-4-9-5-2-7/h7,9H,1-6H2
InChIKeyXDCICCGXZKDFHO-UHFFFAOYSA-N
MW195.26 g/mol
LogP0.12
Rot. Bonds3

About 4-(2-fluoroethylsulfonyl)piperidine

4-(2-fluoroethylsulfonyl)piperidine (PubChem CID 84666246) has the molecular formula C7H14FNO2S and a molecular weight of 195.26 g/mol. Its IUPAC name is 4-(2-fluoroethylsulfonyl)piperidine.

Molecular Properties

Compound Name4-(2-fluoroethylsulfonyl)piperidine
PubChem CID84666246
Molecular FormulaC7H14FNO2S
Molecular Weight195.26 g/mol
Exact Mass195.07
IUPAC Name4-(2-fluoroethylsulfonyl)piperidine
SMILESO=S(=O)(CCF)C1CCNCC1
InChIInChI=1S/C7H14FNO2S/c8-3-6-12(10,11)7-1-4-9-5-2-7/h7,9H,1-6H2
InChIKeyXDCICCGXZKDFHO-UHFFFAOYSA-N
XLogP0.12
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Methanesulfonylpiperidine
CID 22275823
4-Methanesulfonylpiperidine hydrochloride
CID 23061698
4-(Propane-1-sulfonyl)piperidine hydrochloride
CID 66686902
4-(Ethanesulfonyl)piperidine hydrochloride
CID 67529535
4-(Propane-2-sulfonyl)piperidine hydrochloride
CID 71757881
4-(Methanesulfonyl)piperidine
CID 22275038
Piperidine-4-sulfonyl fluoride
CID 87150313
(R)-3-(Methylsulfonyl)piperidine hydrochloride
CID 122170300
Piperidine-3-sulfonyl fluoride hydrochloride
CID 132327883
4-Difluoromethanesulfonylpiperidine hydrochloride
CID 154814546
2-Methylthiomorpholine 1,1-dioxide
CID 14953860
4-(Ethanesulfonyl)piperidine
CID 53404297

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoroethylsulfonyl)piperidine?
The IUPAC name of 4-(2-fluoroethylsulfonyl)piperidine (CID 84666246) is 4-(2-fluoroethylsulfonyl)piperidine.
What is the SMILES notation for 4-(2-fluoroethylsulfonyl)piperidine?
The canonical SMILES for 4-(2-fluoroethylsulfonyl)piperidine is O=S(=O)(CCF)C1CCNCC1.
What is the InChIKey of 4-(2-fluoroethylsulfonyl)piperidine?
The InChIKey is XDCICCGXZKDFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO2S/c8-3-6-12(10,11)7-1-4-9-5-2-7/h7,9H,1-6H2.
What are the key properties of 4-(2-fluoroethylsulfonyl)piperidine?
4-(2-fluoroethylsulfonyl)piperidine has a molecular weight of 195.26 g/mol, XLogP of 0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoroethylsulfonyl)piperidine is sourced from PubChem (CID 84666246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).