2-propylsulfanyl-5-thiophen-2-ylthiophene

C11H12S3 — CID 100914409

IUPAC2-propylsulfanyl-5-thiophen-2-ylthiophene
SMILESCCCSc1ccc(-c2cccs2)s1
InChIInChI=1S/C11H12S3/c1-2-7-13-11-6-5-10(14-11)9-4-3-8-12-9/h3-6,8H,2,7H2,1H3
InChIKeyJVZGPCUAWDJGPT-UHFFFAOYSA-N
MW240.42 g/mol
LogP4.98
Rot. Bonds4

About 2-propylsulfanyl-5-thiophen-2-ylthiophene

2-propylsulfanyl-5-thiophen-2-ylthiophene (PubChem CID 100914409) has the molecular formula C11H12S3 and a molecular weight of 240.42 g/mol. Its IUPAC name is 2-propylsulfanyl-5-thiophen-2-ylthiophene.

Molecular Properties

Compound Name2-propylsulfanyl-5-thiophen-2-ylthiophene
PubChem CID100914409
Molecular FormulaC11H12S3
Molecular Weight240.42 g/mol
Exact Mass240.01
IUPAC Name2-propylsulfanyl-5-thiophen-2-ylthiophene
SMILESCCCSc1ccc(-c2cccs2)s1
InChIInChI=1S/C11H12S3/c1-2-7-13-11-6-5-10(14-11)9-4-3-8-12-9/h3-6,8H,2,7H2,1H3
InChIKeyJVZGPCUAWDJGPT-UHFFFAOYSA-N
XLogP4.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dithiophen-2-ylthiophene;ethane
CID 169103820
2,5-bis(5-octylsulfanylthiophen-2-yl)thiophene
CID 71361773
2-methyl-5-thiophen-2-ylthiophene;propane
CID 142257628
2-thiophen-2-yl-5-[5-(2,4,6-trimethylphenyl)sulfanylthiophen-2-yl]thiophene
CID 102388798
dibutyl-[dibutyl-(5-thiophen-2-ylthiophen-2-yl)silyl]-(5-thiophen-2-ylthiophen-2-yl)silane
CID 101060108
2-(2-methylbutan-2-yl)-5-[5-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene
CID 129214307
but-1-yne;2-thiophen-2-ylthiophene
CID 174755152
2-(3,5-diethylphenyl)-5-thiophen-2-ylthiophene
CID 141257815
1-(5-thiophen-2-ylthiophen-2-yl)propan-1-ol
CID 18920444
dichloro-methyl-(5-thiophen-2-ylthiophen-2-yl)silane
CID 25000318
tris[5-[5-(5-butylsulfanylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-tris[5-[5-(5-butylsulfanylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]silyloxysilane
CID 102132032
triethoxy-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]silane
CID 59664325

Frequently Asked Questions

What is the IUPAC name of 2-propylsulfanyl-5-thiophen-2-ylthiophene?
The IUPAC name of 2-propylsulfanyl-5-thiophen-2-ylthiophene (CID 100914409) is 2-propylsulfanyl-5-thiophen-2-ylthiophene.
What is the SMILES notation for 2-propylsulfanyl-5-thiophen-2-ylthiophene?
The canonical SMILES for 2-propylsulfanyl-5-thiophen-2-ylthiophene is CCCSc1ccc(-c2cccs2)s1.
What is the InChIKey of 2-propylsulfanyl-5-thiophen-2-ylthiophene?
The InChIKey is JVZGPCUAWDJGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12S3/c1-2-7-13-11-6-5-10(14-11)9-4-3-8-12-9/h3-6,8H,2,7H2,1H3.
What are the key properties of 2-propylsulfanyl-5-thiophen-2-ylthiophene?
2-propylsulfanyl-5-thiophen-2-ylthiophene has a molecular weight of 240.42 g/mol, XLogP of 4.98, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propylsulfanyl-5-thiophen-2-ylthiophene is sourced from PubChem (CID 100914409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).