2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide

C13H15N3O4S — CID 167431092

IUPAC2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
SMILESCC(=O)Nc1sccc1CC(=O)NC1CCC(=O)NC1=O
InChIInChI=1S/C13H15N3O4S/c1-7(17)14-13-8(4-5-21-13)6-11(19)15-9-2-3-10(18)16-12(9)20/h4-5,9H,2-3,6H2,1H3,(H,14,17)(H,15,19)(H,16,18,20)
InChIKeyGNTSSQYTKNJPTC-UHFFFAOYSA-N
MW309.35 g/mol
LogP0.17
Rot. Bonds4

About 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide

2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide (PubChem CID 167431092) has the molecular formula C13H15N3O4S and a molecular weight of 309.35 g/mol. Its IUPAC name is 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
PubChem CID167431092
Molecular FormulaC13H15N3O4S
Molecular Weight309.35 g/mol
Exact Mass309.08
IUPAC Name2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
SMILESCC(=O)Nc1sccc1CC(=O)NC1CCC(=O)NC1=O
InChIInChI=1S/C13H15N3O4S/c1-7(17)14-13-8(4-5-21-13)6-11(19)15-9-2-3-10(18)16-12(9)20/h4-5,9H,2-3,6H2,1H3,(H,14,17)(H,15,19)(H,16,18,20)
InChIKeyGNTSSQYTKNJPTC-UHFFFAOYSA-N
XLogP0.17
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.35
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-acetamido-N-(2,6-dioxopiperidin-3-yl)thiophene-3-carboxamide
CID 156408625
2-[2-acetamido-5-(trifluoromethyl)thiophen-3-yl]-N-(2,6-dioxopiperidin-3-yl)acetamide
CID 167431021
3-Thiophen-3-ylpiperazin-2-one
CID 62352453
N-(2,6-Dioxo-3-piperidinyl)-2-(methylamino)-3-thiophenecarboxamide
CID 156408736
N-(2,6-dioxopiperidin-3-yl)-5,8-dihydro-4H-thieno[2,3-b]azepine-3-carboxamide
CID 156438425
N-(2,6-dioxopiperidin-3-yl)-5-(ethenylamino)-4-propylthiophene-3-carboxamide
CID 156744916
N-(2,6-dioxopiperidin-3-yl)-5-(prop-1-en-2-ylamino)-4-propylthiophene-3-carboxamide
CID 156744972
3-[(5-Propan-2-ylthiophen-2-yl)amino]piperidine-2,6-dione
CID 164720392
3-[(4-Propan-2-ylthiophen-2-yl)amino]piperidine-2,6-dione
CID 164720792
2-[5-chloro-2-(methylamino)thiophen-3-yl]-N-(2,6-dioxopiperidin-3-yl)acetamide
CID 167431014
2-(2-acetamido-5-phenylthiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
CID 167431022
N-[5-chloro-3-[2-[(2,6-dioxopiperidin-3-yl)amino]-2-oxoethyl]thiophen-2-yl]pentanamide
CID 167431027

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The IUPAC name of 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide (CID 167431092) is 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The canonical SMILES for 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide is CC(=O)Nc1sccc1CC(=O)NC1CCC(=O)NC1=O.
What is the InChIKey of 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The InChIKey is GNTSSQYTKNJPTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O4S/c1-7(17)14-13-8(4-5-21-13)6-11(19)15-9-2-3-10(18)16-12(9)20/h4-5,9H,2-3,6H2,1H3,(H,14,17)(H,15,19)(H,16,18,20).
What are the key properties of 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide has a molecular weight of 309.35 g/mol, XLogP of 0.17, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide is sourced from PubChem (CID 167431092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).