N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide

C11H12N2O4S — CID 144658134

IUPACN-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide
SMILESCCNC(=O)c1c(O)c2sccc2n(OC)c1=O
InChIInChI=1S/C11H12N2O4S/c1-3-12-10(15)7-8(14)9-6(4-5-18-9)13(17-2)11(7)16/h4-5,14H,3H2,1-2H3,(H,12,15)
InChIKeyLNGFNMLBJSGZTD-UHFFFAOYSA-N
MW268.29 g/mol
LogP0.58
Rot. Bonds3

About N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide

N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide (PubChem CID 144658134) has the molecular formula C11H12N2O4S and a molecular weight of 268.29 g/mol. Its IUPAC name is N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide
PubChem CID144658134
Molecular FormulaC11H12N2O4S
Molecular Weight268.29 g/mol
Exact Mass268.05
IUPAC NameN-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide
SMILESCCNC(=O)c1c(O)c2sccc2n(OC)c1=O
InChIInChI=1S/C11H12N2O4S/c1-3-12-10(15)7-8(14)9-6(4-5-18-9)13(17-2)11(7)16/h4-5,14H,3H2,1-2H3,(H,12,15)
InChIKeyLNGFNMLBJSGZTD-UHFFFAOYSA-N
XLogP0.58
TPSA80.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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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
Methyl 5,7-dihydroxythieno[3,2-b]pyridine-6-carboxylate
CID 54734580
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
7-Hydroxy-5-oxo-4,5-dihydro-thieno[3,2-b]pyridine-6-carbonitrile
CID 54679170
4-Ethyl-7-hydroxy-6-nitrothieno[3,2-b]pyridin-5-one
CID 54705224
4-Butyl-7-hydroxy-6-nitrothieno[3,2-b]pyridin-5-one
CID 54705225
7-Hydroxy-4-(2-methylpropyl)-6-nitrothieno[3,2-b]pyridin-5-one
CID 54705227
7-Hydroxy-6-nitro-4-propan-2-ylthieno[3,2-b]pyridin-5-one
CID 54705229
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

Frequently Asked Questions

What is the IUPAC name of N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide?
The IUPAC name of N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide (CID 144658134) is N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide.
What is the SMILES notation for N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide?
The canonical SMILES for N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide is CCNC(=O)c1c(O)c2sccc2n(OC)c1=O.
What is the InChIKey of N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide?
The InChIKey is LNGFNMLBJSGZTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O4S/c1-3-12-10(15)7-8(14)9-6(4-5-18-9)13(17-2)11(7)16/h4-5,14H,3H2,1-2H3,(H,12,15).
What are the key properties of N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide?
N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide has a molecular weight of 268.29 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-7-hydroxy-4-methoxy-5-oxothieno[3,2-b]pyridine-6-carboxamide is sourced from PubChem (CID 144658134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).