2,5-bis(4-ethoxyphenyl)thiophene

C20H20O2S — CID 154402016

IUPAC2,5-bis(4-ethoxyphenyl)thiophene
SMILESCCOc1ccc(-c2ccc(-c3ccc(OCC)cc3)s2)cc1
InChIInChI=1S/C20H20O2S/c1-3-21-17-9-5-15(6-10-17)19-13-14-20(23-19)16-7-11-18(12-8-16)22-4-2/h5-14H,3-4H2,1-2H3
InChIKeyYTBXLNUULRWPHQ-UHFFFAOYSA-N
MW324.45 g/mol
LogP5.88
Rot. Bonds6

About 2,5-bis(4-ethoxyphenyl)thiophene

2,5-bis(4-ethoxyphenyl)thiophene (PubChem CID 154402016) has the molecular formula C20H20O2S and a molecular weight of 324.45 g/mol. Its IUPAC name is 2,5-bis(4-ethoxyphenyl)thiophene.

Molecular Properties

Compound Name2,5-bis(4-ethoxyphenyl)thiophene
PubChem CID154402016
Molecular FormulaC20H20O2S
Molecular Weight324.45 g/mol
Exact Mass324.12
IUPAC Name2,5-bis(4-ethoxyphenyl)thiophene
SMILESCCOc1ccc(-c2ccc(-c3ccc(OCC)cc3)s2)cc1
InChIInChI=1S/C20H20O2S/c1-3-21-17-9-5-15(6-10-17)19-13-14-20(23-19)16-7-11-18(12-8-16)22-4-2/h5-14H,3-4H2,1-2H3
InChIKeyYTBXLNUULRWPHQ-UHFFFAOYSA-N
XLogP5.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.45
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-ethoxyphenyl)thiophene-2-sulfonamide
CID 121010461
2-amino-1-[5-(4-ethoxyphenyl)thiophen-2-yl]ethanone
CID 94273700
2,5-bis(4-but-2-enoxyphenyl)thiophene
CID 54197936
2,5-bis[4-(4-methoxyphenyl)phenyl]thiophene
CID 16751334
2,5-bis[5-[4-(4-methoxyphenyl)phenyl]thiophen-2-yl]thiophene
CID 132513911
1-ethoxy-4-[4-(4-methylphenoxy)butoxy]benzene
CID 2283416
N-benzyl-5-(4-ethoxyphenyl)thiophene-2-carboxamide
CID 46083104
N,N-dibenzyl-5-(4-ethoxyphenyl)thiophene-2-carboxamide
CID 46082653
2-(4-ethylphenyl)-5-[4-[5-(4-ethylphenyl)thiophen-2-yl]phenyl]thiophene
CID 139942065
2-ethyl-5-(4-methoxyphenyl)thiophene
CID 21064460
2-butoxy-5-[4-(4-dodecoxyphenyl)phenyl]thiophene
CID 10863935
2-bromo-5-(4-ethoxyphenyl)-4-methyl-1,3-thiazole
CID 82135118

Frequently Asked Questions

What is the IUPAC name of 2,5-bis(4-ethoxyphenyl)thiophene?
The IUPAC name of 2,5-bis(4-ethoxyphenyl)thiophene (CID 154402016) is 2,5-bis(4-ethoxyphenyl)thiophene.
What is the SMILES notation for 2,5-bis(4-ethoxyphenyl)thiophene?
The canonical SMILES for 2,5-bis(4-ethoxyphenyl)thiophene is CCOc1ccc(-c2ccc(-c3ccc(OCC)cc3)s2)cc1.
What is the InChIKey of 2,5-bis(4-ethoxyphenyl)thiophene?
The InChIKey is YTBXLNUULRWPHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20O2S/c1-3-21-17-9-5-15(6-10-17)19-13-14-20(23-19)16-7-11-18(12-8-16)22-4-2/h5-14H,3-4H2,1-2H3.
What are the key properties of 2,5-bis(4-ethoxyphenyl)thiophene?
2,5-bis(4-ethoxyphenyl)thiophene has a molecular weight of 324.45 g/mol, XLogP of 5.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(4-ethoxyphenyl)thiophene is sourced from PubChem (CID 154402016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).