4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine

C11H15F2NS — CID 116840351

IUPAC4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine
SMILESFC(F)(CC1CCNCC1)c1cccs1
InChIInChI=1S/C11H15F2NS/c12-11(13,10-2-1-7-15-10)8-9-3-5-14-6-4-9/h1-2,7,9,14H,3-6,8H2
InChIKeyQJEJJJALIGAKMW-UHFFFAOYSA-N
MW231.31 g/mol
LogP3.23
Rot. Bonds3

About 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine

4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine (PubChem CID 116840351) has the molecular formula C11H15F2NS and a molecular weight of 231.31 g/mol. Its IUPAC name is 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine.

Molecular Properties

Compound Name4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine
PubChem CID116840351
Molecular FormulaC11H15F2NS
Molecular Weight231.31 g/mol
Exact Mass231.09
IUPAC Name4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine
SMILESFC(F)(CC1CCNCC1)c1cccs1
InChIInChI=1S/C11H15F2NS/c12-11(13,10-2-1-7-15-10)8-9-3-5-14-6-4-9/h1-2,7,9,14H,3-6,8H2
InChIKeyQJEJJJALIGAKMW-UHFFFAOYSA-N
XLogP3.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.31
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine?
The IUPAC name of 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine (CID 116840351) is 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine.
What is the SMILES notation for 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine?
The canonical SMILES for 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine is FC(F)(CC1CCNCC1)c1cccs1.
What is the InChIKey of 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine?
The InChIKey is QJEJJJALIGAKMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2NS/c12-11(13,10-2-1-7-15-10)8-9-3-5-14-6-4-9/h1-2,7,9,14H,3-6,8H2.
What are the key properties of 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine?
4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine has a molecular weight of 231.31 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluoro-2-thiophen-2-ylethyl)piperidine is sourced from PubChem (CID 116840351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).