7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide

C9H8N2O2S — CID 91293974

IUPAC7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide
SMILESCn1cc(C(N)=O)c(=O)c2ccsc21
InChIInChI=1S/C9H8N2O2S/c1-11-4-6(8(10)13)7(12)5-2-3-14-9(5)11/h2-4H,1H3,(H2,10,13)
InChIKeyJUKCBBFSSBVYGK-UHFFFAOYSA-N
MW208.24 g/mol
LogP0.70
Rot. Bonds1

About 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide

7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide (PubChem CID 91293974) has the molecular formula C9H8N2O2S and a molecular weight of 208.24 g/mol. Its IUPAC name is 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide
PubChem CID91293974
Molecular FormulaC9H8N2O2S
Molecular Weight208.24 g/mol
Exact Mass208.03
IUPAC Name7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide
SMILESCn1cc(C(N)=O)c(=O)c2ccsc21
InChIInChI=1S/C9H8N2O2S/c1-11-4-6(8(10)13)7(12)5-2-3-14-9(5)11/h2-4H,1H3,(H2,10,13)
InChIKeyJUKCBBFSSBVYGK-UHFFFAOYSA-N
XLogP0.70
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide?
The IUPAC name of 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide (CID 91293974) is 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide.
What is the SMILES notation for 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide?
The canonical SMILES for 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide is Cn1cc(C(N)=O)c(=O)c2ccsc21.
What is the InChIKey of 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide?
The InChIKey is JUKCBBFSSBVYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2S/c1-11-4-6(8(10)13)7(12)5-2-3-14-9(5)11/h2-4H,1H3,(H2,10,13).
What are the key properties of 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide?
7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide has a molecular weight of 208.24 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-4-oxothieno[2,3-b]pyridine-5-carboxamide is sourced from PubChem (CID 91293974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).