1-(3-fluoropropylsulfonyl)piperidine

C8H16FNO2S — CID 129349168

IUPAC1-(3-fluoropropylsulfonyl)piperidine
SMILESO=S(=O)(CCCF)N1CCCCC1
InChIInChI=1S/C8H16FNO2S/c9-5-4-8-13(11,12)10-6-2-1-3-7-10/h1-8H2
InChIKeyWEJOHCKWQJVPFN-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.16
Rot. Bonds4

About 1-(3-fluoropropylsulfonyl)piperidine

1-(3-fluoropropylsulfonyl)piperidine (PubChem CID 129349168) has the molecular formula C8H16FNO2S and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(3-fluoropropylsulfonyl)piperidine.

Molecular Properties

Compound Name1-(3-fluoropropylsulfonyl)piperidine
PubChem CID129349168
Molecular FormulaC8H16FNO2S
Molecular Weight209.29 g/mol
Exact Mass209.09
IUPAC Name1-(3-fluoropropylsulfonyl)piperidine
SMILESO=S(=O)(CCCF)N1CCCCC1
InChIInChI=1S/C8H16FNO2S/c9-5-4-8-13(11,12)10-6-2-1-3-7-10/h1-8H2
InChIKeyWEJOHCKWQJVPFN-UHFFFAOYSA-N
XLogP1.16
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropropylsulfonyl)piperidine?
The IUPAC name of 1-(3-fluoropropylsulfonyl)piperidine (CID 129349168) is 1-(3-fluoropropylsulfonyl)piperidine.
What is the SMILES notation for 1-(3-fluoropropylsulfonyl)piperidine?
The canonical SMILES for 1-(3-fluoropropylsulfonyl)piperidine is O=S(=O)(CCCF)N1CCCCC1.
What is the InChIKey of 1-(3-fluoropropylsulfonyl)piperidine?
The InChIKey is WEJOHCKWQJVPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO2S/c9-5-4-8-13(11,12)10-6-2-1-3-7-10/h1-8H2.
What are the key properties of 1-(3-fluoropropylsulfonyl)piperidine?
1-(3-fluoropropylsulfonyl)piperidine has a molecular weight of 209.29 g/mol, XLogP of 1.16, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropropylsulfonyl)piperidine is sourced from PubChem (CID 129349168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).