ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate

C15H22O2S — CID 10778190

IUPACethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate
SMILESCCOC(=O)CC1(CCc2cccs2)CCCC1
InChIInChI=1S/C15H22O2S/c1-2-17-14(16)12-15(8-3-4-9-15)10-7-13-6-5-11-18-13/h5-6,11H,2-4,7-10,12H2,1H3
InChIKeyJAINSQXZCWBVTA-UHFFFAOYSA-N
MW266.41 g/mol
LogP4.19
Rot. Bonds6

About ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate

ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate (PubChem CID 10778190) has the molecular formula C15H22O2S and a molecular weight of 266.41 g/mol. Its IUPAC name is ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate.

Molecular Properties

Compound Nameethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate
PubChem CID10778190
Molecular FormulaC15H22O2S
Molecular Weight266.41 g/mol
Exact Mass266.13
IUPAC Nameethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate
SMILESCCOC(=O)CC1(CCc2cccs2)CCCC1
InChIInChI=1S/C15H22O2S/c1-2-17-14(16)12-15(8-3-4-9-15)10-7-13-6-5-11-18-13/h5-6,11H,2-4,7-10,12H2,1H3
InChIKeyJAINSQXZCWBVTA-UHFFFAOYSA-N
XLogP4.19
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate 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-(2-thiophen-2-ylethyl)cyclopentan-1-amine
CID 63774974
ethyl 2-(2-thiophen-2-ylethylcarbamoylamino)acetate
CID 43445634
ethyl 2-[methyl(3-thiophen-2-ylpropanoyl)amino]acetate
CID 55003743
ethyl 2-(thiophen-2-ylmethoxy)acetate
CID 60730801
ethyl 2-(thionin-2-yl)acetate
CID 174897632
ethyl 2-[propyl(thiophen-2-ylmethyl)amino]acetate
CID 62027701
2-methyl-N-[2-[1-(2-thiophen-2-ylethyl)cyclopentyl]ethyl]propan-2-amine
CID 65304602
ethyl 3-hydroxy-4-(2-thiophen-2-ylethylamino)butanoate
CID 103235530
ethyl 2-[(2-thiophen-2-ylacetyl)amino]acetate
CID 4632592
2-(1-aminocyclopentyl)-N-cyclopropyl-N-(thiophen-2-ylmethyl)acetamide
CID 64686059
1-(1-hydroxycyclohexyl)-3-thiophen-2-ylpropan-1-one
CID 103449732
ethyl 2-[bis(thiophen-2-ylmethyl)amino]-2-oxoacetate
CID 166273196

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate?
The IUPAC name of ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate (CID 10778190) is ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate.
What is the SMILES notation for ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate?
The canonical SMILES for ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate is CCOC(=O)CC1(CCc2cccs2)CCCC1.
What is the InChIKey of ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate?
The InChIKey is JAINSQXZCWBVTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2S/c1-2-17-14(16)12-15(8-3-4-9-15)10-7-13-6-5-11-18-13/h5-6,11H,2-4,7-10,12H2,1H3.
What are the key properties of ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate?
ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate has a molecular weight of 266.41 g/mol, XLogP of 4.19, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[1-(2-thiophen-2-ylethyl)cyclopentyl]acetate is sourced from PubChem (CID 10778190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).