5-ethylthieno[3,2-c]pyridin-4-one

C9H9NOS — CID 115886528

IUPAC5-ethylthieno[3,2-c]pyridin-4-one
SMILESCCn1ccc2sccc2c1=O
InChIInChI=1S/C9H9NOS/c1-2-10-5-3-8-7(9(10)11)4-6-12-8/h3-6H,2H2,1H3
InChIKeyVEESGDFEFCOMEY-UHFFFAOYSA-N
MW179.24 g/mol
LogP2.08
Rot. Bonds1

About 5-ethylthieno[3,2-c]pyridin-4-one

5-ethylthieno[3,2-c]pyridin-4-one (PubChem CID 115886528) has the molecular formula C9H9NOS and a molecular weight of 179.24 g/mol. Its IUPAC name is 5-ethylthieno[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name5-ethylthieno[3,2-c]pyridin-4-one
PubChem CID115886528
Molecular FormulaC9H9NOS
Molecular Weight179.24 g/mol
Exact Mass179.04
IUPAC Name5-ethylthieno[3,2-c]pyridin-4-one
SMILESCCn1ccc2sccc2c1=O
InChIInChI=1S/C9H9NOS/c1-2-10-5-3-8-7(9(10)11)4-6-12-8/h3-6H,2H2,1H3
InChIKeyVEESGDFEFCOMEY-UHFFFAOYSA-N
XLogP2.08
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(ethoxymethyl)thieno[3,2-c]pyridin-4-one
CID 104599398
5-[(E)-but-2-enyl]thieno[3,2-c]pyridin-4-one
CID 116626889
5-but-2-ynylthieno[3,2-c]pyridin-4-one
CID 115886548
2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 115886517
3-(4-oxothieno[3,2-c]pyridin-5-yl)propanoic acid
CID 112556961
5-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]thieno[3,2-c]pyridin-4-one
CID 103985821
5-[2-(bromomethyl)-3,3-dimethylbutyl]thieno[3,2-c]pyridin-4-one
CID 112557005
5-(2-propan-2-ylsulfonylethyl)thieno[3,2-c]pyridin-4-one
CID 106731694
5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one
CID 116626911
5-(5-hydroxypentyl)thieno[3,2-c]pyridin-4-one
CID 112557081
5-[(4-bromophenyl)methyl]thieno[3,2-c]pyridin-4-one
CID 113347683
5-(9-sulfanylnonyl)thieno[3,2-c]pyridin-4-one
CID 105344666

Frequently Asked Questions

What is the IUPAC name of 5-ethylthieno[3,2-c]pyridin-4-one?
The IUPAC name of 5-ethylthieno[3,2-c]pyridin-4-one (CID 115886528) is 5-ethylthieno[3,2-c]pyridin-4-one.
What is the SMILES notation for 5-ethylthieno[3,2-c]pyridin-4-one?
The canonical SMILES for 5-ethylthieno[3,2-c]pyridin-4-one is CCn1ccc2sccc2c1=O.
What is the InChIKey of 5-ethylthieno[3,2-c]pyridin-4-one?
The InChIKey is VEESGDFEFCOMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NOS/c1-2-10-5-3-8-7(9(10)11)4-6-12-8/h3-6H,2H2,1H3.
What are the key properties of 5-ethylthieno[3,2-c]pyridin-4-one?
5-ethylthieno[3,2-c]pyridin-4-one has a molecular weight of 179.24 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylthieno[3,2-c]pyridin-4-one is sourced from PubChem (CID 115886528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).