5-naphthalen-2-ylthieno[3,2-b]thiophene

C16H10S2 — CID 134966612

IUPAC5-naphthalen-2-ylthieno[3,2-b]thiophene
SMILESc1ccc2cc(-c3cc4sccc4s3)ccc2c1
InChIInChI=1S/C16H10S2/c1-2-4-12-9-13(6-5-11(12)3-1)15-10-16-14(18-15)7-8-17-16/h1-10H
InChIKeyDLNQUOWICDFMSH-UHFFFAOYSA-N
MW266.39 g/mol
LogP5.78
Rot. Bonds1

About 5-naphthalen-2-ylthieno[3,2-b]thiophene

5-naphthalen-2-ylthieno[3,2-b]thiophene (PubChem CID 134966612) has the molecular formula C16H10S2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 5-naphthalen-2-ylthieno[3,2-b]thiophene.

Molecular Properties

Compound Name5-naphthalen-2-ylthieno[3,2-b]thiophene
PubChem CID134966612
Molecular FormulaC16H10S2
Molecular Weight266.39 g/mol
Exact Mass266.02
IUPAC Name5-naphthalen-2-ylthieno[3,2-b]thiophene
SMILESc1ccc2cc(-c3cc4sccc4s3)ccc2c1
InChIInChI=1S/C16H10S2/c1-2-4-12-9-13(6-5-11(12)3-1)15-10-16-14(18-15)7-8-17-16/h1-10H
InChIKeyDLNQUOWICDFMSH-UHFFFAOYSA-N
XLogP5.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.39
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-2-ylthieno[3,2-b]thiophene?
The IUPAC name of 5-naphthalen-2-ylthieno[3,2-b]thiophene (CID 134966612) is 5-naphthalen-2-ylthieno[3,2-b]thiophene.
What is the SMILES notation for 5-naphthalen-2-ylthieno[3,2-b]thiophene?
The canonical SMILES for 5-naphthalen-2-ylthieno[3,2-b]thiophene is c1ccc2cc(-c3cc4sccc4s3)ccc2c1.
What is the InChIKey of 5-naphthalen-2-ylthieno[3,2-b]thiophene?
The InChIKey is DLNQUOWICDFMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10S2/c1-2-4-12-9-13(6-5-11(12)3-1)15-10-16-14(18-15)7-8-17-16/h1-10H.
What are the key properties of 5-naphthalen-2-ylthieno[3,2-b]thiophene?
5-naphthalen-2-ylthieno[3,2-b]thiophene has a molecular weight of 266.39 g/mol, XLogP of 5.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-2-ylthieno[3,2-b]thiophene is sourced from PubChem (CID 134966612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).