piperidine-1-sulfonyl fluoride

C5H10FNO2S — CID 12955991

IUPACpiperidine-1-sulfonyl fluoride
SMILESO=S(=O)(F)N1CCCCC1
InChIInChI=1S/C5H10FNO2S/c6-10(8,9)7-4-2-1-3-5-7/h1-5H2
InChIKeySSXRYWUKQFCOIW-UHFFFAOYSA-N
MW167.20 g/mol
LogP0.69
Rot. Bonds1

About piperidine-1-sulfonyl fluoride

piperidine-1-sulfonyl fluoride (PubChem CID 12955991) has the molecular formula C5H10FNO2S and a molecular weight of 167.20 g/mol. Its IUPAC name is piperidine-1-sulfonyl fluoride.

Molecular Properties

Compound Namepiperidine-1-sulfonyl fluoride
PubChem CID12955991
Molecular FormulaC5H10FNO2S
Molecular Weight167.20 g/mol
Exact Mass167.04
IUPAC Namepiperidine-1-sulfonyl fluoride
SMILESO=S(=O)(F)N1CCCCC1
InChIInChI=1S/C5H10FNO2S/c6-10(8,9)7-4-2-1-3-5-7/h1-5H2
InChIKeySSXRYWUKQFCOIW-UHFFFAOYSA-N
XLogP0.69
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.20
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Piperidinesulfonamide
CID 276741
Piperidine-1-sulfonyl chloride
CID 11298344
4,4-Difluoropiperidine-1-sulfonyl chloride
CID 53256750
1-Piperidinesulfonic acid
CID 558632
N,N-dimethylpiperidine-1-sulfonamide
CID 222099
Piperidine-1-sulfinate
CID 21623765
4-Fluoropiperidine-1-sulfonyl chloride
CID 53256753
1-Fluoropiperidin-1-ium-1-sulfonic acid
CID 57040286
4,4-Difluoropiperidine-1-sulfinate
CID 89881608
3-Fluoropiperidine-1-sulfinate
CID 117605594
4-Fluoropiperidine-1-sulfonamide
CID 134821832
Piperidin-1-yl thiohypofluorite
CID 141370448

Frequently Asked Questions

What is the IUPAC name of piperidine-1-sulfonyl fluoride?
The IUPAC name of piperidine-1-sulfonyl fluoride (CID 12955991) is piperidine-1-sulfonyl fluoride.
What is the SMILES notation for piperidine-1-sulfonyl fluoride?
The canonical SMILES for piperidine-1-sulfonyl fluoride is O=S(=O)(F)N1CCCCC1.
What is the InChIKey of piperidine-1-sulfonyl fluoride?
The InChIKey is SSXRYWUKQFCOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO2S/c6-10(8,9)7-4-2-1-3-5-7/h1-5H2.
What are the key properties of piperidine-1-sulfonyl fluoride?
piperidine-1-sulfonyl fluoride has a molecular weight of 167.20 g/mol, XLogP of 0.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-1-sulfonyl fluoride is sourced from PubChem (CID 12955991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).