7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one

C8H7NO2S — CID 135366958

IUPAC7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one
SMILESCn1c(=O)cc(O)c2sccc21
InChIInChI=1S/C8H7NO2S/c1-9-5-2-3-12-8(5)6(10)4-7(9)11/h2-4,10H,1H3
InChIKeyDXCCNOVRSVCQIK-UHFFFAOYSA-N
MW181.22 g/mol
LogP1.31
Rot. Bonds

About 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one

7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one (PubChem CID 135366958) has the molecular formula C8H7NO2S and a molecular weight of 181.22 g/mol. Its IUPAC name is 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one.

Molecular Properties

Compound Name7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one
PubChem CID135366958
Molecular FormulaC8H7NO2S
Molecular Weight181.22 g/mol
Exact Mass181.02
IUPAC Name7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one
SMILESCn1c(=O)cc(O)c2sccc21
InChIInChI=1S/C8H7NO2S/c1-9-5-2-3-12-8(5)6(10)4-7(9)11/h2-4,10H,1H3
InChIKeyDXCCNOVRSVCQIK-UHFFFAOYSA-N
XLogP1.31
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.22
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Thieno(3,2-b)pyridine-5,7-diol
CID 54679747
(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
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
7-Hydroxy-4-methyl-6-nitrothieno[3,2-b]pyridin-5-one
CID 54714003
N-tert-butyl-7-hydroxy-5-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
CID 54729680
2-Methylthieno[3,2-B]pyridine-5,7-diol
CID 56604060
7-Hydroxy-6-nitro-4-propylthieno[3,2-b]pyridin-5-one
CID 57092429

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one?
The IUPAC name of 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one (CID 135366958) is 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one.
What is the SMILES notation for 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one?
The canonical SMILES for 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one is Cn1c(=O)cc(O)c2sccc21.
What is the InChIKey of 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one?
The InChIKey is DXCCNOVRSVCQIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO2S/c1-9-5-2-3-12-8(5)6(10)4-7(9)11/h2-4,10H,1H3.
What are the key properties of 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one?
7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one has a molecular weight of 181.22 g/mol, XLogP of 1.31, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-4-methylthieno[3,2-b]pyridin-5-one is sourced from PubChem (CID 135366958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).