2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene

C17H14S2 — CID 139982091

IUPAC2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene
SMILESC=C(C)c1ccc(-c2ccc(-c3cccs3)s2)cc1
InChIInChI=1S/C17H14S2/c1-12(2)13-5-7-14(8-6-13)15-9-10-17(19-15)16-4-3-11-18-16/h3-11H,1H2,2H3
InChIKeyWRIMERLYWUCIQQ-UHFFFAOYSA-N
MW282.43 g/mol
LogP6.18
Rot. Bonds3

About 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene

2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene (PubChem CID 139982091) has the molecular formula C17H14S2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene.

Molecular Properties

Compound Name2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene
PubChem CID139982091
Molecular FormulaC17H14S2
Molecular Weight282.43 g/mol
Exact Mass282.05
IUPAC Name2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene
SMILESC=C(C)c1ccc(-c2ccc(-c3cccs3)s2)cc1
InChIInChI=1S/C17H14S2/c1-12(2)13-5-7-14(8-6-13)15-9-10-17(19-15)16-4-3-11-18-16/h3-11H,1H2,2H3
InChIKeyWRIMERLYWUCIQQ-UHFFFAOYSA-N
XLogP6.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.43
LogP ≤ 56.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dithiophen-2-ylthiophene;ethane
CID 169103820
[4-(5-thiophen-2-ylthiophen-2-yl)phenyl]boronic acid
CID 101473229
2-[8,8-bis(4-tert-butylphenyl)-21,21-bis(4-prop-1-en-2-ylphenyl)-5-(5-thiophen-2-ylthiophen-2-yl)-18-hexacyclo[11.10.1.02,7.09,24.014,22.015,20]tetracosa-1(23),2(7),3,5,9,11,13(24),14(22),15(20),16,18-undecaenyl]-5-thiophen-2-ylthiophene
CID 89256163
2-thiophen-2-yl-5-[6-(5-thiophen-2-ylthiophen-2-yl)anthracen-2-yl]thiophene
CID 23596942
2-thiophen-2-yl-5-[4-(2,2,2-trifluoroethyl)phenyl]thiophene
CID 163635945
4-N-(4-aminophenyl)-4-N-[4-(5-thiophen-2-ylthiophen-2-yl)phenyl]benzene-1,4-diamine
CID 102055550
2-[3-(4-methoxyphenyl)-5-(5-thiophen-2-ylthiophen-2-yl)phenyl]-5-thiophen-2-ylthiophene
CID 25194683
2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene
CID 141257815
[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]methyl 2-methylprop-2-enoate
CID 86183810
2-fluoro-4-(5-thiophen-2-ylthiophen-2-yl)benzonitrile
CID 155806543
4-thiophen-2-ylbenzoyl chloride
CID 158319353
[5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]methanol
CID 15838027

Frequently Asked Questions

What is the IUPAC name of 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene?
The IUPAC name of 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene (CID 139982091) is 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene.
What is the SMILES notation for 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene?
The canonical SMILES for 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene is C=C(C)c1ccc(-c2ccc(-c3cccs3)s2)cc1.
What is the InChIKey of 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene?
The InChIKey is WRIMERLYWUCIQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14S2/c1-12(2)13-5-7-14(8-6-13)15-9-10-17(19-15)16-4-3-11-18-16/h3-11H,1H2,2H3.
What are the key properties of 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene?
2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene has a molecular weight of 282.43 g/mol, XLogP of 6.18, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-prop-1-en-2-ylphenyl)-5-thiophen-2-ylthiophene is sourced from PubChem (CID 139982091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).