2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide

C9H8N2O2S — CID 115886517

IUPAC2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
SMILESNC(=O)Cn1ccc2sccc2c1=O
InChIInChI=1S/C9H8N2O2S/c10-8(12)5-11-3-1-7-6(9(11)13)2-4-14-7/h1-4H,5H2,(H2,10,12)
InChIKeyVPJWRQJSYSZPRW-UHFFFAOYSA-N
MW208.24 g/mol
LogP0.55
Rot. Bonds2

About 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide

2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide (PubChem CID 115886517) has the molecular formula C9H8N2O2S and a molecular weight of 208.24 g/mol. Its IUPAC name is 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
PubChem CID115886517
Molecular FormulaC9H8N2O2S
Molecular Weight208.24 g/mol
Exact Mass208.03
IUPAC Name2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
SMILESNC(=O)Cn1ccc2sccc2c1=O
InChIInChI=1S/C9H8N2O2S/c10-8(12)5-11-3-1-7-6(9(11)13)2-4-14-7/h1-4H,5H2,(H2,10,12)
InChIKeyVPJWRQJSYSZPRW-UHFFFAOYSA-N
XLogP0.55
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-oxothieno[3,2-c]pyridin-5-yl)methyl]benzamide
CID 115886543
3-(4-oxothieno[3,2-c]pyridin-5-yl)propanoic acid
CID 112556961
5-ethylthieno[3,2-c]pyridin-4-one
CID 115886528
5-(2-cyclohexyl-2-oxoethyl)thieno[3,2-c]pyridin-4-one
CID 103985823
5-(5-hydroxypentyl)thieno[3,2-c]pyridin-4-one
CID 112557081
4-(4-oxothieno[3,2-c]pyridin-5-yl)butanoic acid
CID 112556973
N-(3-aminophenyl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 115912011
N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396035
3-[(4-oxothieno[3,2-c]pyridin-5-yl)methyl]benzamide
CID 115886525
N-cyclohexyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396089
N-(3,5-dimethylphenyl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396068
5-[2-(3-fluorophenyl)-2-oxoethyl]thieno[3,2-c]pyridin-4-one
CID 115912066

Frequently Asked Questions

What is the IUPAC name of 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The IUPAC name of 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide (CID 115886517) is 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide.
What is the SMILES notation for 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The canonical SMILES for 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide is NC(=O)Cn1ccc2sccc2c1=O.
What is the InChIKey of 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The InChIKey is VPJWRQJSYSZPRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2S/c10-8(12)5-11-3-1-7-6(9(11)13)2-4-14-7/h1-4H,5H2,(H2,10,12).
What are the key properties of 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide has a molecular weight of 208.24 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide is sourced from PubChem (CID 115886517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).