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

C14H23NS — CID 114426164

IUPAC4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine
SMILESCCC1CCNC(CCc2sccc2C)C1
InChIInChI=1S/C14H23NS/c1-3-12-6-8-15-13(10-12)4-5-14-11(2)7-9-16-14/h7,9,12-13,15H,3-6,8,10H2,1-2H3
InChIKeyGXTAIXBWNZGYSM-UHFFFAOYSA-N
MW237.41 g/mol
LogP3.77
Rot. Bonds4

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

4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine (PubChem CID 114426164) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine.

Molecular Properties

Compound Name4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine
PubChem CID114426164
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC Name4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine
SMILESCCC1CCNC(CCc2sccc2C)C1
InChIInChI=1S/C14H23NS/c1-3-12-6-8-15-13(10-12)4-5-14-11(2)7-9-16-14/h7,9,12-13,15H,3-6,8,10H2,1-2H3
InChIKeyGXTAIXBWNZGYSM-UHFFFAOYSA-N
XLogP3.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-2-[2-(3-methylthiophen-2-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

Related Compounds

2-[2-(4-butylphenyl)ethyl]-4-ethylpiperidine
CID 114426186
2-[2-(2,5-dichlorophenyl)ethyl]-4-ethylpiperidine
CID 114426169
2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-ethylpiperidine
CID 114426180
4-ethyl-2-[2-(3-fluoro-4-methoxyphenyl)ethyl]piperidine
CID 114426204
N-[(4-ethylpiperidin-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 114132011
4-ethyl-N-[(3-ethylthiophen-2-yl)methyl]piperidine-2-carboxamide
CID 114429306
1-(4-ethylpiperidin-2-yl)-N-methyl-N-[(2-methylphenyl)methyl]methanamine
CID 114430836
N-[(4-ethylpiperidin-2-yl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 106052624
4-ethyl-2-(3-methoxy-3-methylbutyl)piperidine
CID 103037375
4-ethyl-2-[2-(trifluoromethylsulfanyl)ethyl]piperidine
CID 116627033
N-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-pyrrolidin-3-ylethanamine
CID 115210838
1-(4-ethylpiperidin-2-yl)-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine
CID 114430985

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine?
The IUPAC name of 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine (CID 114426164) is 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine.
What is the SMILES notation for 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine?
The canonical SMILES for 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine is CCC1CCNC(CCc2sccc2C)C1.
What is the InChIKey of 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine?
The InChIKey is GXTAIXBWNZGYSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-3-12-6-8-15-13(10-12)4-5-14-11(2)7-9-16-14/h7,9,12-13,15H,3-6,8,10H2,1-2H3.
What are the key properties of 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine?
4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine has a molecular weight of 237.41 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[2-(3-methylthiophen-2-yl)ethyl]piperidine is sourced from PubChem (CID 114426164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).