3-bromothieno[2,3-b]thiophen-5-amine

C6H4BrNS2 — CID 133056754

IUPAC3-bromothieno[2,3-b]thiophen-5-amine
SMILESNc1cc2c(Br)csc2s1
InChIInChI=1S/C6H4BrNS2/c7-4-2-9-6-3(4)1-5(8)10-6/h1-2H,8H2
InChIKeyVOIKXOGMYKDRJX-UHFFFAOYSA-N
MW234.14 g/mol
LogP3.31
Rot. Bonds

About 3-bromothieno[2,3-b]thiophen-5-amine

3-bromothieno[2,3-b]thiophen-5-amine (PubChem CID 133056754) has the molecular formula C6H4BrNS2 and a molecular weight of 234.14 g/mol. Its IUPAC name is 3-bromothieno[2,3-b]thiophen-5-amine.

Molecular Properties

Compound Name3-bromothieno[2,3-b]thiophen-5-amine
PubChem CID133056754
Molecular FormulaC6H4BrNS2
Molecular Weight234.14 g/mol
Exact Mass232.90
IUPAC Name3-bromothieno[2,3-b]thiophen-5-amine
SMILESNc1cc2c(Br)csc2s1
InChIInChI=1S/C6H4BrNS2/c7-4-2-9-6-3(4)1-5(8)10-6/h1-2H,8H2
InChIKeyVOIKXOGMYKDRJX-UHFFFAOYSA-N
XLogP3.31
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.14
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-bromothieno[2,3-b]thiophen-5-amine?
The IUPAC name of 3-bromothieno[2,3-b]thiophen-5-amine (CID 133056754) is 3-bromothieno[2,3-b]thiophen-5-amine.
What is the SMILES notation for 3-bromothieno[2,3-b]thiophen-5-amine?
The canonical SMILES for 3-bromothieno[2,3-b]thiophen-5-amine is Nc1cc2c(Br)csc2s1.
What is the InChIKey of 3-bromothieno[2,3-b]thiophen-5-amine?
The InChIKey is VOIKXOGMYKDRJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrNS2/c7-4-2-9-6-3(4)1-5(8)10-6/h1-2H,8H2.
What are the key properties of 3-bromothieno[2,3-b]thiophen-5-amine?
3-bromothieno[2,3-b]thiophen-5-amine has a molecular weight of 234.14 g/mol, XLogP of 3.31, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromothieno[2,3-b]thiophen-5-amine is sourced from PubChem (CID 133056754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).