3-ethylperoxy-2-thiophen-2-ylthiophene

C10H10O2S2 — CID 141423205

IUPAC3-ethylperoxy-2-thiophen-2-ylthiophene
SMILESCCOOc1ccsc1-c1cccs1
InChIInChI=1S/C10H10O2S2/c1-2-11-12-8-5-7-14-10(8)9-4-3-6-13-9/h3-7H,2H2,1H3
InChIKeyUSOLQPJJXQQGPA-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.81
Rot. Bonds4

About 3-ethylperoxy-2-thiophen-2-ylthiophene

3-ethylperoxy-2-thiophen-2-ylthiophene (PubChem CID 141423205) has the molecular formula C10H10O2S2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 3-ethylperoxy-2-thiophen-2-ylthiophene.

Molecular Properties

Compound Name3-ethylperoxy-2-thiophen-2-ylthiophene
PubChem CID141423205
Molecular FormulaC10H10O2S2
Molecular Weight226.32 g/mol
Exact Mass226.01
IUPAC Name3-ethylperoxy-2-thiophen-2-ylthiophene
SMILESCCOOc1ccsc1-c1cccs1
InChIInChI=1S/C10H10O2S2/c1-2-11-12-8-5-7-14-10(8)9-4-3-6-13-9/h3-7H,2H2,1H3
InChIKeyUSOLQPJJXQQGPA-UHFFFAOYSA-N
XLogP3.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze 3-ethylperoxy-2-thiophen-2-ylthiophene 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

3-methoxy-2-thiophen-2-ylthiophene
CID 18353954
3-propyl-2-thiophen-2-ylthiophene
CID 69104145
2,3-diethoxy-5,7-dithiophen-2-ylthieno[3,4-b]pyrazine
CID 102108621
but-1-yne;2-thiophen-2-ylthiophene
CID 174755152
2-(4-ethoxy-2,3-difluorophenyl)thiophene
CID 143775731
2-(5-ethyl-2-methoxyphenyl)thiophene
CID 20651347
2-thiophen-2-yl-3-[5-[2-[2-[2-[2-[5-(2-thiophen-2-ylthiophen-3-yl)pentoxy]ethoxy]ethoxy]ethoxy]ethoxy]pentyl]thiophene
CID 100949175
triethoxy-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]silane
CID 59664325
2-thiophen-2-yl-5-(5-thiophen-2-ylfuran-2-yl)furan
CID 102347671
2-(ethoxymethyl)thiophene
CID 12699283
ethyl 2-[[4-[(2-ethoxy-2-oxoacetyl)amino]-2,5-dithiophen-2-ylthiophen-3-yl]amino]-2-oxoacetate
CID 101036688
3-(9-fluorononyl)-2-thiophen-2-ylthiophene
CID 155899382

Frequently Asked Questions

What is the IUPAC name of 3-ethylperoxy-2-thiophen-2-ylthiophene?
The IUPAC name of 3-ethylperoxy-2-thiophen-2-ylthiophene (CID 141423205) is 3-ethylperoxy-2-thiophen-2-ylthiophene.
What is the SMILES notation for 3-ethylperoxy-2-thiophen-2-ylthiophene?
The canonical SMILES for 3-ethylperoxy-2-thiophen-2-ylthiophene is CCOOc1ccsc1-c1cccs1.
What is the InChIKey of 3-ethylperoxy-2-thiophen-2-ylthiophene?
The InChIKey is USOLQPJJXQQGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2S2/c1-2-11-12-8-5-7-14-10(8)9-4-3-6-13-9/h3-7H,2H2,1H3.
What are the key properties of 3-ethylperoxy-2-thiophen-2-ylthiophene?
3-ethylperoxy-2-thiophen-2-ylthiophene has a molecular weight of 226.32 g/mol, XLogP of 3.81, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylperoxy-2-thiophen-2-ylthiophene is sourced from PubChem (CID 141423205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).