N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide

C13H16N2O3S — CID 103985530

IUPACN-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
SMILESCOCC(C)NC(=O)Cn1ccc2sccc2c1=O
InChIInChI=1S/C13H16N2O3S/c1-9(8-18-2)14-12(16)7-15-5-3-11-10(13(15)17)4-6-19-11/h3-6,9H,7-8H2,1-2H3,(H,14,16)
InChIKeySCBGVFMJHGCDCA-UHFFFAOYSA-N
MW280.35 g/mol
LogP1.21
Rot. Bonds5

About N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide

N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide (PubChem CID 103985530) has the molecular formula C13H16N2O3S and a molecular weight of 280.35 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
PubChem CID103985530
Molecular FormulaC13H16N2O3S
Molecular Weight280.35 g/mol
Exact Mass280.09
IUPAC NameN-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
SMILESCOCC(C)NC(=O)Cn1ccc2sccc2c1=O
InChIInChI=1S/C13H16N2O3S/c1-9(8-18-2)14-12(16)7-15-5-3-11-10(13(15)17)4-6-19-11/h3-6,9H,7-8H2,1-2H3,(H,14,16)
InChIKeySCBGVFMJHGCDCA-UHFFFAOYSA-N
XLogP1.21
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-1-methoxypropan-2-yl]-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 40898847
N-(3,5-dimethoxyphenyl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396038
N-(1-methoxypropan-2-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 51174931
N-(3,5-dimethylphenyl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396068
2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 115886517
N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396035
N-(3-aminophenyl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 115912011
5-[2-(2-methoxyethylamino)ethyl]thieno[3,2-c]pyridin-4-one
CID 112557132
N-cyclohexyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396089
N-(3-fluorophenyl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396043
N-(1-methoxypropan-2-yl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 17397674
2-(6-bromo-4-oxoquinolin-1-yl)-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 100737711

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide (CID 103985530) is N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide is COCC(C)NC(=O)Cn1ccc2sccc2c1=O.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The InChIKey is SCBGVFMJHGCDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3S/c1-9(8-18-2)14-12(16)7-15-5-3-11-10(13(15)17)4-6-19-11/h3-6,9H,7-8H2,1-2H3,(H,14,16).
What are the key properties of N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide has a molecular weight of 280.35 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide is sourced from PubChem (CID 103985530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).