thieno[2,3-b]pyridin-4-ylmethanamine

C8H8N2S — CID 82414814

IUPACthieno[2,3-b]pyridin-4-ylmethanamine
SMILESNCc1ccnc2sccc12
InChIInChI=1S/C8H8N2S/c9-5-6-1-3-10-8-7(6)2-4-11-8/h1-4H,5,9H2
InChIKeyZLWPSZIDLHZEMD-UHFFFAOYSA-N
MW164.23 g/mol
LogP1.75
Rot. Bonds1

About thieno[2,3-b]pyridin-4-ylmethanamine

thieno[2,3-b]pyridin-4-ylmethanamine (PubChem CID 82414814) has the molecular formula C8H8N2S and a molecular weight of 164.23 g/mol. Its IUPAC name is thieno[2,3-b]pyridin-4-ylmethanamine.

Molecular Properties

Compound Namethieno[2,3-b]pyridin-4-ylmethanamine
PubChem CID82414814
Molecular FormulaC8H8N2S
Molecular Weight164.23 g/mol
Exact Mass164.04
IUPAC Namethieno[2,3-b]pyridin-4-ylmethanamine
SMILESNCc1ccnc2sccc12
InChIInChI=1S/C8H8N2S/c9-5-6-1-3-10-8-7(6)2-4-11-8/h1-4H,5,9H2
InChIKeyZLWPSZIDLHZEMD-UHFFFAOYSA-N
XLogP1.75
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of thieno[2,3-b]pyridin-4-ylmethanamine?
The IUPAC name of thieno[2,3-b]pyridin-4-ylmethanamine (CID 82414814) is thieno[2,3-b]pyridin-4-ylmethanamine.
What is the SMILES notation for thieno[2,3-b]pyridin-4-ylmethanamine?
The canonical SMILES for thieno[2,3-b]pyridin-4-ylmethanamine is NCc1ccnc2sccc12.
What is the InChIKey of thieno[2,3-b]pyridin-4-ylmethanamine?
The InChIKey is ZLWPSZIDLHZEMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2S/c9-5-6-1-3-10-8-7(6)2-4-11-8/h1-4H,5,9H2.
What are the key properties of thieno[2,3-b]pyridin-4-ylmethanamine?
thieno[2,3-b]pyridin-4-ylmethanamine has a molecular weight of 164.23 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[2,3-b]pyridin-4-ylmethanamine is sourced from PubChem (CID 82414814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).