7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide

C11H10N2O4S — CID 89227037

IUPAC7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide
SMILESCn1c(=O)c(C(=O)NCC=O)c(O)c2sccc21
InChIInChI=1S/C11H10N2O4S/c1-13-6-2-5-18-9(6)8(15)7(11(13)17)10(16)12-3-4-14/h2,4-5,15H,3H2,1H3,(H,12,16)
InChIKeyVVHUMOMGFUKPHA-UHFFFAOYSA-N
MW266.28 g/mol
LogP0.23
Rot. Bonds3

About 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide

7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide (PubChem CID 89227037) has the molecular formula C11H10N2O4S and a molecular weight of 266.28 g/mol. Its IUPAC name is 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide
PubChem CID89227037
Molecular FormulaC11H10N2O4S
Molecular Weight266.28 g/mol
Exact Mass266.04
IUPAC Name7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide
SMILESCn1c(=O)c(C(=O)NCC=O)c(O)c2sccc21
InChIInChI=1S/C11H10N2O4S/c1-13-6-2-5-18-9(6)8(15)7(11(13)17)10(16)12-3-4-14/h2,4-5,15H,3H2,1H3,(H,12,16)
InChIKeyVVHUMOMGFUKPHA-UHFFFAOYSA-N
XLogP0.23
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(7-Hydroxy-4-methyl-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carboxamido)acetic Acid
CID 54749369
(3Z)-3-[ethylamino(hydroxy)methylidene]-1-methyl-2,2-dioxothieno[3,2-c]thiazin-4-one
CID 54696630
ethyl 7-hydroxy-4-methyl-5-oxo-4H,5H-thieno[3,2-b]pyridine-6-carboxylate
CID 57744891
4-benzyl-2-[4-(3-methylbenzoyl)piperazin-1-yl]pyrido[2,3-b]pyrazin-3(4H)-one
CID 54733598
7-hydroxy-5-oxo-N-(thiophen-2-ylmethyl)-4,5-dihydrothieno[3,2-b]pyridine-6-carboxamide
CID 54734532
Ethyl 5,7-dihydroxythieno[3,2-b]pyridine-6-carboxylate
CID 54710119
7-hydroxy-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
CID 54723666
N-tert-butyl-7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
CID 54729680
7-Hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-6-carboxylic acid
CID 54735409
4-butyl-7-hydroxy-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-5-oxothieno[3,2-b]pyridine-6-carboxamide
CID 54736233
2-[(7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carbonyl)amino]acetic acid
CID 54741195
2-[(2-Bromo-7-hydroxy-4-methyl-5-oxothieno[3,2-b]pyridine-6-carbonyl)amino]acetic acid
CID 54741646

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide?
The IUPAC name of 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide (CID 89227037) is 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide.
What is the SMILES notation for 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide?
The canonical SMILES for 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide is Cn1c(=O)c(C(=O)NCC=O)c(O)c2sccc21.
What is the InChIKey of 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide?
The InChIKey is VVHUMOMGFUKPHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O4S/c1-13-6-2-5-18-9(6)8(15)7(11(13)17)10(16)12-3-4-14/h2,4-5,15H,3H2,1H3,(H,12,16).
What are the key properties of 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide?
7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide has a molecular weight of 266.28 g/mol, XLogP of 0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-4-methyl-5-oxo-N-(2-oxoethyl)thieno[3,2-b]pyridine-6-carboxamide is sourced from PubChem (CID 89227037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).