4-(1-fluoro-2-thiophen-2-ylethyl)piperidine

C11H16FNS — CID 112563668

IUPAC4-(1-fluoro-2-thiophen-2-ylethyl)piperidine
SMILESFC(Cc1cccs1)C1CCNCC1
InChIInChI=1S/C11H16FNS/c12-11(8-10-2-1-7-14-10)9-3-5-13-6-4-9/h1-2,7,9,11,13H,3-6,8H2
InChIKeyCXQVOVHUPKHMLF-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.63
Rot. Bonds3

About 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine

4-(1-fluoro-2-thiophen-2-ylethyl)piperidine (PubChem CID 112563668) has the molecular formula C11H16FNS and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine.

Molecular Properties

Compound Name4-(1-fluoro-2-thiophen-2-ylethyl)piperidine
PubChem CID112563668
Molecular FormulaC11H16FNS
Molecular Weight213.32 g/mol
Exact Mass213.10
IUPAC Name4-(1-fluoro-2-thiophen-2-ylethyl)piperidine
SMILESFC(Cc1cccs1)C1CCNCC1
InChIInChI=1S/C11H16FNS/c12-11(8-10-2-1-7-14-10)9-3-5-13-6-4-9/h1-2,7,9,11,13H,3-6,8H2
InChIKeyCXQVOVHUPKHMLF-UHFFFAOYSA-N
XLogP2.63
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 ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(Thiophen-2-yl)-3-aza-bicyclo[3.1.0]hexane
CID 44561207
3-Thiophen-2-yl-1-aza-bicyclo[2.2.2]oct-2-ene
CID 11819882
(1R,5R)-1-(2-Thienyl)-3-azabicyclo[3.1.0]hexane
CID 44561208
(1S,5S)-1-(2-Thienyl)-3-azabicyclo[3.1.0]hexane
CID 44561209
4-(2-Thienyl)piperidine
CID 19095574
4-(3-Thienyl)piperidine
CID 19847314
8-[5-(Piperidin-4-ylmethyl)thiophen-2-yl]octan-1-amine
CID 16126037
(cis)-2-Methyl-1-(thiophen-2-yl)-3-aza-bicyclo[3.1.0]hexane
CID 44561131
(trans)-4-Methyl-1-(thiophen-2-yl)-3-aza-bicyclo[3.1.0]hexane
CID 44561210
(cis)-4-Methyl-1-(thiophen-2-yl)-3-aza-bicyclo[3.1.0]hexane
CID 44561211
1-(5-(Trifluoromethyl)thiophen-2-yl)-3-aza-bicyclo[3.1.0]hexane
CID 44561251
(1S,5S)-1-(5-fluorothiophen-2-yl)-3-aza-bicyclo[3.1.0]hexane
CID 44561256

Frequently Asked Questions

What is the IUPAC name of 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine?
The IUPAC name of 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine (CID 112563668) is 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine.
What is the SMILES notation for 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine?
The canonical SMILES for 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine is FC(Cc1cccs1)C1CCNCC1.
What is the InChIKey of 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine?
The InChIKey is CXQVOVHUPKHMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNS/c12-11(8-10-2-1-7-14-10)9-3-5-13-6-4-9/h1-2,7,9,11,13H,3-6,8H2.
What are the key properties of 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine?
4-(1-fluoro-2-thiophen-2-ylethyl)piperidine has a molecular weight of 213.32 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-fluoro-2-thiophen-2-ylethyl)piperidine is sourced from PubChem (CID 112563668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).