5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol

C18H12OS2 — CID 11045057

IUPAC5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol
SMILESOc1ccc2c(-c3ccc(-c4cccs4)s3)cccc2c1
InChIInChI=1S/C18H12OS2/c19-13-6-7-14-12(11-13)3-1-4-15(14)16-8-9-18(21-16)17-5-2-10-20-17/h1-11,19H
InChIKeyVFUTZWQPYYOHAU-UHFFFAOYSA-N
MW308.43 g/mol
LogP6.00
Rot. Bonds2

About 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol

5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol (PubChem CID 11045057) has the molecular formula C18H12OS2 and a molecular weight of 308.43 g/mol. Its IUPAC name is 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol.

Molecular Properties

Compound Name5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol
PubChem CID11045057
Molecular FormulaC18H12OS2
Molecular Weight308.43 g/mol
Exact Mass308.03
IUPAC Name5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol
SMILESOc1ccc2c(-c3ccc(-c4cccs4)s3)cccc2c1
InChIInChI=1S/C18H12OS2/c19-13-6-7-14-12(11-13)3-1-4-15(14)16-8-9-18(21-16)17-5-2-10-20-17/h1-11,19H
InChIKeyVFUTZWQPYYOHAU-UHFFFAOYSA-N
XLogP6.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.43
LogP ≤ 56.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol?
The IUPAC name of 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol (CID 11045057) is 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol.
What is the SMILES notation for 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol?
The canonical SMILES for 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol is Oc1ccc2c(-c3ccc(-c4cccs4)s3)cccc2c1.
What is the InChIKey of 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol?
The InChIKey is VFUTZWQPYYOHAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12OS2/c19-13-6-7-14-12(11-13)3-1-4-15(14)16-8-9-18(21-16)17-5-2-10-20-17/h1-11,19H.
What are the key properties of 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol?
5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol has a molecular weight of 308.43 g/mol, XLogP of 6.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-thiophen-2-ylthiophen-2-yl)naphthalen-2-ol is sourced from PubChem (CID 11045057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).