4H-thieno[3,2-b]pyrrol-5-ol

C6H5NOS — CID 69288383

IUPAC4H-thieno[3,2-b]pyrrol-5-ol
SMILESOc1cc2sccc2[nH]1
InChIInChI=1S/C6H5NOS/c8-6-3-5-4(7-6)1-2-9-5/h1-3,7-8H
InChIKeyGEUXORIBDOYIPQ-UHFFFAOYSA-N
MW139.18 g/mol
LogP1.93
Rot. Bonds

About 4H-thieno[3,2-b]pyrrol-5-ol

4H-thieno[3,2-b]pyrrol-5-ol (PubChem CID 69288383) has the molecular formula C6H5NOS and a molecular weight of 139.18 g/mol. Its IUPAC name is 4H-thieno[3,2-b]pyrrol-5-ol.

Molecular Properties

Compound Name4H-thieno[3,2-b]pyrrol-5-ol
PubChem CID69288383
Molecular FormulaC6H5NOS
Molecular Weight139.18 g/mol
Exact Mass139.01
IUPAC Name4H-thieno[3,2-b]pyrrol-5-ol
SMILESOc1cc2sccc2[nH]1
InChIInChI=1S/C6H5NOS/c8-6-3-5-4(7-6)1-2-9-5/h1-3,7-8H
InChIKeyGEUXORIBDOYIPQ-UHFFFAOYSA-N
XLogP1.93
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.18
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4H-thieno[3,2-b]pyrrol-5-ol?
The IUPAC name of 4H-thieno[3,2-b]pyrrol-5-ol (CID 69288383) is 4H-thieno[3,2-b]pyrrol-5-ol.
What is the SMILES notation for 4H-thieno[3,2-b]pyrrol-5-ol?
The canonical SMILES for 4H-thieno[3,2-b]pyrrol-5-ol is Oc1cc2sccc2[nH]1.
What is the InChIKey of 4H-thieno[3,2-b]pyrrol-5-ol?
The InChIKey is GEUXORIBDOYIPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5NOS/c8-6-3-5-4(7-6)1-2-9-5/h1-3,7-8H.
What are the key properties of 4H-thieno[3,2-b]pyrrol-5-ol?
4H-thieno[3,2-b]pyrrol-5-ol has a molecular weight of 139.18 g/mol, XLogP of 1.93, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-thieno[3,2-b]pyrrol-5-ol is sourced from PubChem (CID 69288383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).