7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide

C13H16N2O3S — CID 67984165

IUPAC7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide
SMILESCc1csc2c(O)c(C(=O)NC(C)C)c(=O)n(C)c12
InChIInChI=1S/C13H16N2O3S/c1-6(2)14-12(17)8-10(16)11-9(7(3)5-19-11)15(4)13(8)18/h5-6,16H,1-4H3,(H,14,17)
InChIKeyWKCZZHODZYMFDJ-UHFFFAOYSA-N
MW280.35 g/mol
LogP1.75
Rot. Bonds2

About 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide

7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide (PubChem CID 67984165) has the molecular formula C13H16N2O3S and a molecular weight of 280.35 g/mol. Its IUPAC name is 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide
PubChem CID67984165
Molecular FormulaC13H16N2O3S
Molecular Weight280.35 g/mol
Exact Mass280.09
IUPAC Name7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide
SMILESCc1csc2c(O)c(C(=O)NC(C)C)c(=O)n(C)c12
InChIInChI=1S/C13H16N2O3S/c1-6(2)14-12(17)8-10(16)11-9(7(3)5-19-11)15(4)13(8)18/h5-6,16H,1-4H3,(H,14,17)
InChIKeyWKCZZHODZYMFDJ-UHFFFAOYSA-N
XLogP1.75
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide 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 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide?
The IUPAC name of 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide (CID 67984165) is 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide.
What is the SMILES notation for 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide?
The canonical SMILES for 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide is Cc1csc2c(O)c(C(=O)NC(C)C)c(=O)n(C)c12.
What is the InChIKey of 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide?
The InChIKey is WKCZZHODZYMFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3S/c1-6(2)14-12(17)8-10(16)11-9(7(3)5-19-11)15(4)13(8)18/h5-6,16H,1-4H3,(H,14,17).
What are the key properties of 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide?
7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide has a molecular weight of 280.35 g/mol, XLogP of 1.75, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-3,4-dimethyl-5-oxo-N-propan-2-ylthieno[3,2-b]pyridine-6-carboxamide is sourced from PubChem (CID 67984165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).