2-ethyl-2-(2-thiophen-2-ylethyl)piperidine

C13H21NS — CID 117271805

IUPAC2-ethyl-2-(2-thiophen-2-ylethyl)piperidine
SMILESCCC1(CCc2cccs2)CCCCN1
InChIInChI=1S/C13H21NS/c1-2-13(8-3-4-10-14-13)9-7-12-6-5-11-15-12/h5-6,11,14H,2-4,7-10H2,1H3
InChIKeyTYGYYAGGTCKBEJ-UHFFFAOYSA-N
MW223.38 g/mol
LogP3.60
Rot. Bonds4

About 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine

2-ethyl-2-(2-thiophen-2-ylethyl)piperidine (PubChem CID 117271805) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine.

Molecular Properties

Compound Name2-ethyl-2-(2-thiophen-2-ylethyl)piperidine
PubChem CID117271805
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC Name2-ethyl-2-(2-thiophen-2-ylethyl)piperidine
SMILESCCC1(CCc2cccs2)CCCCN1
InChIInChI=1S/C13H21NS/c1-2-13(8-3-4-10-14-13)9-7-12-6-5-11-15-12/h5-6,11,14H,2-4,7-10H2,1H3
InChIKeyTYGYYAGGTCKBEJ-UHFFFAOYSA-N
XLogP3.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine?
The IUPAC name of 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine (CID 117271805) is 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine.
What is the SMILES notation for 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine?
The canonical SMILES for 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine is CCC1(CCc2cccs2)CCCCN1.
What is the InChIKey of 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine?
The InChIKey is TYGYYAGGTCKBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-2-13(8-3-4-10-14-13)9-7-12-6-5-11-15-12/h5-6,11,14H,2-4,7-10H2,1H3.
What are the key properties of 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine?
2-ethyl-2-(2-thiophen-2-ylethyl)piperidine has a molecular weight of 223.38 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(2-thiophen-2-ylethyl)piperidine is sourced from PubChem (CID 117271805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).