2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene

C18H18S2 — CID 141257815

IUPAC2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene
SMILESCCc1cc(CC)cc(-c2ccc(-c3cccs3)s2)c1
InChIInChI=1S/C18H18S2/c1-3-13-10-14(4-2)12-15(11-13)16-7-8-18(20-16)17-6-5-9-19-17/h5-12H,3-4H2,1-2H3
InChIKeyOSBITSDPPGQIQZ-UHFFFAOYSA-N
MW298.48 g/mol
LogP6.27
Rot. Bonds4

About 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene

2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene (PubChem CID 141257815) has the molecular formula C18H18S2 and a molecular weight of 298.48 g/mol. Its IUPAC name is 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene.

Molecular Properties

Compound Name2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene
PubChem CID141257815
Molecular FormulaC18H18S2
Molecular Weight298.48 g/mol
Exact Mass298.08
IUPAC Name2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene
SMILESCCc1cc(CC)cc(-c2ccc(-c3cccs3)s2)c1
InChIInChI=1S/C18H18S2/c1-3-13-10-14(4-2)12-15(11-13)16-7-8-18(20-16)17-6-5-9-19-17/h5-12H,3-4H2,1-2H3
InChIKeyOSBITSDPPGQIQZ-UHFFFAOYSA-N
XLogP6.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.48
LogP ≤ 56.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dithiophen-2-ylthiophene;ethane
CID 169103820
2-[3-(4-methoxyphenyl)-5-(5-thiophen-2-ylthiophen-2-yl)phenyl]-5-thiophen-2-ylthiophene
CID 25194683
2-methyl-5-thiophen-2-ylthiophene;propane
CID 142257628
2-thiophen-2-yl-5-[6-(5-thiophen-2-ylthiophen-2-yl)anthracen-2-yl]thiophene
CID 23596942
2-(2-methylbutan-2-yl)-5-[5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene
CID 129214307
2-(2-ethyl-3-methylphenyl)-5-thiophen-2-ylthiophene
CID 141257893
2-thiophen-2-yl-5-[4-(2,2,2-trifluoroethyl)phenyl]thiophene
CID 163635945
2-(4-ethylphenyl)-5-[5-[5-[5-[5-[5-(4-ethylphenyl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophene
CID 139982263
9-ethyl-3-(5-thiophen-2-ylthiophen-2-yl)carbazole
CID 59403674
3-(3-chloro-5-ethylphenyl)-2-[5-(5-hexylthiophen-2-yl)thiophen-2-yl]-5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophene
CID 68915856
5-(2,6-diethyl-4-thiophen-2-ylphenyl)thiophene-2-carbaldehyde
CID 141257761
ethyl 5-(5-thiophen-2-ylthiophen-2-yl)thiophene-2-carboxylate
CID 58814529

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene?
The IUPAC name of 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene (CID 141257815) is 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene.
What is the SMILES notation for 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene?
The canonical SMILES for 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene is CCc1cc(CC)cc(-c2ccc(-c3cccs3)s2)c1.
What is the InChIKey of 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene?
The InChIKey is OSBITSDPPGQIQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18S2/c1-3-13-10-14(4-2)12-15(11-13)16-7-8-18(20-16)17-6-5-9-19-17/h5-12H,3-4H2,1-2H3.
What are the key properties of 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene?
2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene has a molecular weight of 298.48 g/mol, XLogP of 6.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene is sourced from PubChem (CID 141257815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).