2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride

C8H11ClN2OS — CID 141094460

IUPAC2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride
SMILESCl.NC(=O)C1CC2=C(C=CNC2)S1
InChIInChI=1S/C8H10N2OS.ClH/c9-8(11)7-3-5-4-10-2-1-6(5)12-7;/h1-2,7,10H,3-4H2,(H2,9,11);1H
InChIKeyNKBXAYAXOQHVDI-UHFFFAOYSA-N
MW218.71 g/mol
LogP0.77
Rot. Bonds1

About 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride

2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride (PubChem CID 141094460) has the molecular formula C8H11ClN2OS and a molecular weight of 218.71 g/mol. Its IUPAC name is 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride
PubChem CID141094460
Molecular FormulaC8H11ClN2OS
Molecular Weight218.71 g/mol
Exact Mass218.03
IUPAC Name2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride
SMILESCl.NC(=O)C1CC2=C(C=CNC2)S1
InChIInChI=1S/C8H10N2OS.ClH/c9-8(11)7-3-5-4-10-2-1-6(5)12-7;/h1-2,7,10H,3-4H2,(H2,9,11);1H
InChIKeyNKBXAYAXOQHVDI-UHFFFAOYSA-N
XLogP0.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.71
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride 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 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride?
The IUPAC name of 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride (CID 141094460) is 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride.
What is the SMILES notation for 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride?
The canonical SMILES for 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride is Cl.NC(=O)C1CC2=C(C=CNC2)S1.
What is the InChIKey of 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride?
The InChIKey is NKBXAYAXOQHVDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2OS.ClH/c9-8(11)7-3-5-4-10-2-1-6(5)12-7;/h1-2,7,10H,3-4H2,(H2,9,11);1H.
What are the key properties of 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride?
2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride has a molecular weight of 218.71 g/mol, XLogP of 0.77, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrochloride is sourced from PubChem (CID 141094460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).