1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine

C14H23NS — CID 142603316

IUPAC1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine
SMILESCCc1scc(C)c1CCN1CCCCC1
InChIInChI=1S/C14H23NS/c1-3-14-13(12(2)11-16-14)7-10-15-8-5-4-6-9-15/h11H,3-10H2,1-2H3
InChIKeyWLXAZIRURGAWCN-UHFFFAOYSA-N
MW237.41 g/mol
LogP3.65
Rot. Bonds4

About 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine

1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine (PubChem CID 142603316) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine.

Molecular Properties

Compound Name1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine
PubChem CID142603316
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC Name1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine
SMILESCCc1scc(C)c1CCN1CCCCC1
InChIInChI=1S/C14H23NS/c1-3-14-13(12(2)11-16-14)7-10-15-8-5-4-6-9-15/h11H,3-10H2,1-2H3
InChIKeyWLXAZIRURGAWCN-UHFFFAOYSA-N
XLogP3.65
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]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 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine?
The IUPAC name of 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine (CID 142603316) is 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine.
What is the SMILES notation for 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine?
The canonical SMILES for 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine is CCc1scc(C)c1CCN1CCCCC1.
What is the InChIKey of 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine?
The InChIKey is WLXAZIRURGAWCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-3-14-13(12(2)11-16-14)7-10-15-8-5-4-6-9-15/h11H,3-10H2,1-2H3.
What are the key properties of 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine?
1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine has a molecular weight of 237.41 g/mol, XLogP of 3.65, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-ethyl-4-methylthiophen-3-yl)ethyl]piperidine is sourced from PubChem (CID 142603316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).