1-thiophen-2-yl-2-(trifluoromethyl)piperazine

C9H11F3N2S — CID 115101316

IUPAC1-thiophen-2-yl-2-(trifluoromethyl)piperazine
SMILESFC(F)(F)C1CNCCN1c1cccs1
InChIInChI=1S/C9H11F3N2S/c10-9(11,12)7-6-13-3-4-14(7)8-2-1-5-15-8/h1-2,5,7,13H,3-4,6H2
InChIKeyIFEAULQJXXSCJO-UHFFFAOYSA-N
MW236.26 g/mol
LogP2.09
Rot. Bonds1

About 1-thiophen-2-yl-2-(trifluoromethyl)piperazine

1-thiophen-2-yl-2-(trifluoromethyl)piperazine (PubChem CID 115101316) has the molecular formula C9H11F3N2S and a molecular weight of 236.26 g/mol. Its IUPAC name is 1-thiophen-2-yl-2-(trifluoromethyl)piperazine.

Molecular Properties

Compound Name1-thiophen-2-yl-2-(trifluoromethyl)piperazine
PubChem CID115101316
Molecular FormulaC9H11F3N2S
Molecular Weight236.26 g/mol
Exact Mass236.06
IUPAC Name1-thiophen-2-yl-2-(trifluoromethyl)piperazine
SMILESFC(F)(F)C1CNCCN1c1cccs1
InChIInChI=1S/C9H11F3N2S/c10-9(11,12)7-6-13-3-4-14(7)8-2-1-5-15-8/h1-2,5,7,13H,3-4,6H2
InChIKeyIFEAULQJXXSCJO-UHFFFAOYSA-N
XLogP2.09
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-thiophen-2-yl-2-(trifluoromethyl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(Thiophen-2-yl)piperidin-4-amine
CID 61680712
1-(Thiophen-2-yl)piperazine
CID 21950130
N-(thienyl-2)ethylenediamine
CID 54066601
1-Thiophen-2-yl-3-(trifluoromethyl)piperazine
CID 140325952
1-[3-(Trifluoromethyl)thiophen-2-yl]piperazine
CID 159445337
N-thiophen-3-yl-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 66352549
1-thiophen-3-yl-N-(2,2,2-trifluoroethyl)piperidin-3-amine
CID 83992381
N-(2,2-difluoroethyl)-1-thiophen-3-ylpiperidin-3-amine
CID 83993075
2-(3-oxo-4-thiophen-2-ylpiperazin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 86795587
3,4-dimethyl-N-thiophen-2-yl-5-(trifluoromethyl)piperazine-1-carboxamide
CID 108487650
N-ethyl-4-thiophen-2-yl-N'-(3,3,3-trifluoropropyl)piperazine-1-carboximidamide;hydroiodide
CID 109719094
N-ethyl-4-thiophen-2-yl-N'-(3,3,3-trifluoropropyl)piperazine-1-carboximidamide
CID 109719095

Frequently Asked Questions

What is the IUPAC name of 1-thiophen-2-yl-2-(trifluoromethyl)piperazine?
The IUPAC name of 1-thiophen-2-yl-2-(trifluoromethyl)piperazine (CID 115101316) is 1-thiophen-2-yl-2-(trifluoromethyl)piperazine.
What is the SMILES notation for 1-thiophen-2-yl-2-(trifluoromethyl)piperazine?
The canonical SMILES for 1-thiophen-2-yl-2-(trifluoromethyl)piperazine is FC(F)(F)C1CNCCN1c1cccs1.
What is the InChIKey of 1-thiophen-2-yl-2-(trifluoromethyl)piperazine?
The InChIKey is IFEAULQJXXSCJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2S/c10-9(11,12)7-6-13-3-4-14(7)8-2-1-5-15-8/h1-2,5,7,13H,3-4,6H2.
What are the key properties of 1-thiophen-2-yl-2-(trifluoromethyl)piperazine?
1-thiophen-2-yl-2-(trifluoromethyl)piperazine has a molecular weight of 236.26 g/mol, XLogP of 2.09, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-2-yl-2-(trifluoromethyl)piperazine is sourced from PubChem (CID 115101316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).