4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine

C11H16FNS — CID 22248036

IUPAC4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine
SMILESFc1ccsc1CCC1CCNCC1
InChIInChI=1S/C11H16FNS/c12-10-5-8-14-11(10)2-1-9-3-6-13-7-4-9/h5,8-9,13H,1-4,6-7H2
InChIKeyIMTOXYRVFUVALH-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.82
Rot. Bonds3

About 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine

4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine (PubChem CID 22248036) has the molecular formula C11H16FNS and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine
PubChem CID22248036
Molecular FormulaC11H16FNS
Molecular Weight213.32 g/mol
Exact Mass213.10
IUPAC Name4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine
SMILESFc1ccsc1CCC1CCNCC1
InChIInChI=1S/C11H16FNS/c12-10-5-8-14-11(10)2-1-9-3-6-13-7-4-9/h5,8-9,13H,1-4,6-7H2
InChIKeyIMTOXYRVFUVALH-UHFFFAOYSA-N
XLogP2.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine?
The IUPAC name of 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine (CID 22248036) is 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine.
What is the SMILES notation for 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine?
The canonical SMILES for 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine is Fc1ccsc1CCC1CCNCC1.
What is the InChIKey of 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine?
The InChIKey is IMTOXYRVFUVALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNS/c12-10-5-8-14-11(10)2-1-9-3-6-13-7-4-9/h5,8-9,13H,1-4,6-7H2.
What are the key properties of 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine?
4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine has a molecular weight of 213.32 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3-fluorothiophen-2-yl)ethyl]piperidine is sourced from PubChem (CID 22248036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).