3-(2-fluoroethylsulfanyl)piperidine

C7H14FNS — CID 84651740

IUPAC3-(2-fluoroethylsulfanyl)piperidine
SMILESFCCSC1CCCNC1
InChIInChI=1S/C7H14FNS/c8-3-5-10-7-2-1-4-9-6-7/h7,9H,1-6H2
InChIKeyWOZDSBDLYNYDIK-UHFFFAOYSA-N
MW163.26 g/mol
LogP1.44
Rot. Bonds3

About 3-(2-fluoroethylsulfanyl)piperidine

3-(2-fluoroethylsulfanyl)piperidine (PubChem CID 84651740) has the molecular formula C7H14FNS and a molecular weight of 163.26 g/mol. Its IUPAC name is 3-(2-fluoroethylsulfanyl)piperidine.

Molecular Properties

Compound Name3-(2-fluoroethylsulfanyl)piperidine
PubChem CID84651740
Molecular FormulaC7H14FNS
Molecular Weight163.26 g/mol
Exact Mass163.08
IUPAC Name3-(2-fluoroethylsulfanyl)piperidine
SMILESFCCSC1CCCNC1
InChIInChI=1S/C7H14FNS/c8-3-5-10-7-2-1-4-9-6-7/h7,9H,1-6H2
InChIKeyWOZDSBDLYNYDIK-UHFFFAOYSA-N
XLogP1.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Propyl-1,3-thiazinane
CID 200393
2-Ethylthiomorpholine
CID 21495166
4-(Methylsulfanyl)piperidine hydrochloride
CID 50998950
2-(Trifluoromethyl)thiomorpholine
CID 91618373
4-[(Trifluoromethyl)sulfanyl]piperidine hydrochloride
CID 91927161
1,4-Dithia-8-azaspiro[4.5]decane
CID 12954120
2-Butyl-1,3-thiazinane
CID 3061406
4-Methylthiopiperidine
CID 17805752
4-Tert-butylsulfanylpiperidine
CID 71778000
4-[(Trifluoromethyl)sulfanyl]piperidine
CID 75530531
3-Fluoro-4-methylsulfanylpiperidine
CID 90176868
(+/-)-cis-3-Fluoro-4-methylsulfanylpiperidine
CID 90183725

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethylsulfanyl)piperidine?
The IUPAC name of 3-(2-fluoroethylsulfanyl)piperidine (CID 84651740) is 3-(2-fluoroethylsulfanyl)piperidine.
What is the SMILES notation for 3-(2-fluoroethylsulfanyl)piperidine?
The canonical SMILES for 3-(2-fluoroethylsulfanyl)piperidine is FCCSC1CCCNC1.
What is the InChIKey of 3-(2-fluoroethylsulfanyl)piperidine?
The InChIKey is WOZDSBDLYNYDIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNS/c8-3-5-10-7-2-1-4-9-6-7/h7,9H,1-6H2.
What are the key properties of 3-(2-fluoroethylsulfanyl)piperidine?
3-(2-fluoroethylsulfanyl)piperidine has a molecular weight of 163.26 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethylsulfanyl)piperidine is sourced from PubChem (CID 84651740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).