5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide

C8H6N2O2S — CID 66942269

IUPAC5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
SMILESNC(=O)c1cc2sccc2[nH]c1=O
InChIInChI=1S/C8H6N2O2S/c9-7(11)4-3-6-5(1-2-13-6)10-8(4)12/h1-3H,(H2,9,11)(H,10,12)
InChIKeyAALNIHOVDVONAW-UHFFFAOYSA-N
MW194.22 g/mol
LogP0.69
Rot. Bonds1

About 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide

5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide (PubChem CID 66942269) has the molecular formula C8H6N2O2S and a molecular weight of 194.22 g/mol. Its IUPAC name is 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
PubChem CID66942269
Molecular FormulaC8H6N2O2S
Molecular Weight194.22 g/mol
Exact Mass194.01
IUPAC Name5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
SMILESNC(=O)c1cc2sccc2[nH]c1=O
InChIInChI=1S/C8H6N2O2S/c9-7(11)4-3-6-5(1-2-13-6)10-8(4)12/h1-3H,(H2,9,11)(H,10,12)
InChIKeyAALNIHOVDVONAW-UHFFFAOYSA-N
XLogP0.69
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.22
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-chlorothieno[3,2-b]pyridin-5(4H)-one
CID 12628603
7-fluoro-4H-thieno[3,2-b]pyridin-5-one
CID 154953939
7-(trifluoromethyl)-4H-thieno[3,2-b]pyridin-5-one
CID 168966904
6-Aminothieno[3,2-b]pyridin-5(4h)-one
CID 117275189
5-oxo-4H-thieno[3,2-b]pyridine-6-carbonitrile
CID 13630973
5-oxo-4H-thieno[3,2-b]pyridine-6-carboxylic acid
CID 23130748
5-Methylidene-3-(thiophen-2-ylmethylidene)-1,4-dihydropyrrolo[3,2-b]pyridin-2-one
CID 57317944
N-(2-methyl-3-thienyl)acetamide
CID 57945277
7-Chloro-5-oxo-4,5-dihydro-thieno[3,2-b]pyridine-6-carbonitrile
CID 59702080
Thieno[3,2-b]pyridin-5(4h)-one
CID 66355418
4,6-Dihydrothieno[3,2-b]azepin-5-one
CID 85714289
6,7,8,9-tetrahydro-4H-thieno[3,2-c][2,7]naphthyridin-5-one
CID 118944736

Frequently Asked Questions

What is the IUPAC name of 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide?
The IUPAC name of 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide (CID 66942269) is 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide.
What is the SMILES notation for 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide?
The canonical SMILES for 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide is NC(=O)c1cc2sccc2[nH]c1=O.
What is the InChIKey of 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide?
The InChIKey is AALNIHOVDVONAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O2S/c9-7(11)4-3-6-5(1-2-13-6)10-8(4)12/h1-3H,(H2,9,11)(H,10,12).
What are the key properties of 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide?
5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide has a molecular weight of 194.22 g/mol, XLogP of 0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide is sourced from PubChem (CID 66942269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).