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

C11H13N3O3S — CID 167431044

IUPAC2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
SMILESNc1sccc1CC(=O)NC1CCC(=O)NC1=O
InChIInChI=1S/C11H13N3O3S/c12-10-6(3-4-18-10)5-9(16)13-7-1-2-8(15)14-11(7)17/h3-4,7H,1-2,5,12H2,(H,13,16)(H,14,15,17)
InChIKeyWQYFHIKQNDJTLF-UHFFFAOYSA-N
MW267.31 g/mol
LogP-0.21
Rot. Bonds3

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

2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide (PubChem CID 167431044) has the molecular formula C11H13N3O3S and a molecular weight of 267.31 g/mol. Its IUPAC name is 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
PubChem CID167431044
Molecular FormulaC11H13N3O3S
Molecular Weight267.31 g/mol
Exact Mass267.07
IUPAC Name2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
SMILESNc1sccc1CC(=O)NC1CCC(=O)NC1=O
InChIInChI=1S/C11H13N3O3S/c12-10-6(3-4-18-10)5-9(16)13-7-1-2-8(15)14-11(7)17/h3-4,7H,1-2,5,12H2,(H,13,16)(H,14,15,17)
InChIKeyWQYFHIKQNDJTLF-UHFFFAOYSA-N
XLogP-0.21
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 5-0.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-Thiophen-3-ylpiperazin-2-one
CID 62352453
(3S,6S)-3-Isobutyl-6-thiophen-3-yl-piperazin-2-one
CID 68158320
2-(2-Piperidin-1-ylethylamino)-2-thiophen-3-ylacetamide
CID 144302651
2-(aminomethyl)-N-(2,6-dioxopiperidin-3-yl)thiophene-3-carboxamide
CID 156408778
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-[acetyl(methyl)amino]thiophen-3-yl]-N-(2,6-dioxopiperidin-3-yl)acetamide
CID 167431038
2-(2-acetamidothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)-N-methylacetamide
CID 167431043
N-(2,6-dioxopiperidin-3-yl)-2-[2-(methylamino)thiophen-3-yl]acetamide
CID 167431046
2-(2-amino-5-chlorothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
CID 167431053
2-(2-acetamido-5-chlorothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide
CID 167431057
2-[4-(aminomethyl)thiophen-2-yl]-N-(2,6-dioxopiperidin-3-yl)acetamide
CID 167431058

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The IUPAC name of 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide (CID 167431044) is 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The canonical SMILES for 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide is Nc1sccc1CC(=O)NC1CCC(=O)NC1=O.
What is the InChIKey of 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The InChIKey is WQYFHIKQNDJTLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O3S/c12-10-6(3-4-18-10)5-9(16)13-7-1-2-8(15)14-11(7)17/h3-4,7H,1-2,5,12H2,(H,13,16)(H,14,15,17).
What are the key properties of 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide?
2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide has a molecular weight of 267.31 g/mol, XLogP of -0.21, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminothiophen-3-yl)-N-(2,6-dioxopiperidin-3-yl)acetamide is sourced from PubChem (CID 167431044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).