2-(aminomethyl)thieno[3,2-b]thiophen-5-ol

C7H7NOS2 — CID 82602213

IUPAC2-(aminomethyl)thieno[3,2-b]thiophen-5-ol
SMILESNCc1cc2sc(O)cc2s1
InChIInChI=1S/C7H7NOS2/c8-3-4-1-5-6(10-4)2-7(9)11-5/h1-2,9H,3,8H2
InChIKeyUCGZCDBYUCDBHN-UHFFFAOYSA-N
MW185.27 g/mol
LogP2.13
Rot. Bonds1

About 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol

2-(aminomethyl)thieno[3,2-b]thiophen-5-ol (PubChem CID 82602213) has the molecular formula C7H7NOS2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol.

Molecular Properties

Compound Name2-(aminomethyl)thieno[3,2-b]thiophen-5-ol
PubChem CID82602213
Molecular FormulaC7H7NOS2
Molecular Weight185.27 g/mol
Exact Mass185.00
IUPAC Name2-(aminomethyl)thieno[3,2-b]thiophen-5-ol
SMILESNCc1cc2sc(O)cc2s1
InChIInChI=1S/C7H7NOS2/c8-3-4-1-5-6(10-4)2-7(9)11-5/h1-2,9H,3,8H2
InChIKeyUCGZCDBYUCDBHN-UHFFFAOYSA-N
XLogP2.13
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol?
The IUPAC name of 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol (CID 82602213) is 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol.
What is the SMILES notation for 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol?
The canonical SMILES for 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol is NCc1cc2sc(O)cc2s1.
What is the InChIKey of 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol?
The InChIKey is UCGZCDBYUCDBHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NOS2/c8-3-4-1-5-6(10-4)2-7(9)11-5/h1-2,9H,3,8H2.
What are the key properties of 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol?
2-(aminomethyl)thieno[3,2-b]thiophen-5-ol has a molecular weight of 185.27 g/mol, XLogP of 2.13, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)thieno[3,2-b]thiophen-5-ol is sourced from PubChem (CID 82602213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).