N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide

C19H14N2O3S — CID 3632857

IUPACN-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide
SMILESO=C(Nc1ccc2sccc2c1)c1cccc(N2C(=O)CCC2=O)c1
InChIInChI=1S/C19H14N2O3S/c22-17-6-7-18(23)21(17)15-3-1-2-13(11-15)19(24)20-14-4-5-16-12(10-14)8-9-25-16/h1-5,8-11H,6-7H2,(H,20,24)
InChIKeyXZWDBGMLYUZIJI-UHFFFAOYSA-N
MW350.40 g/mol
LogP3.81
Rot. Bonds3

About N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide

N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide (PubChem CID 3632857) has the molecular formula C19H14N2O3S and a molecular weight of 350.40 g/mol. Its IUPAC name is N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide
PubChem CID3632857
Molecular FormulaC19H14N2O3S
Molecular Weight350.40 g/mol
Exact Mass350.07
IUPAC NameN-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide
SMILESO=C(Nc1ccc2sccc2c1)c1cccc(N2C(=O)CCC2=O)c1
InChIInChI=1S/C19H14N2O3S/c22-17-6-7-18(23)21(17)15-3-1-2-13(11-15)19(24)20-14-4-5-16-12(10-14)8-9-25-16/h1-5,8-11H,6-7H2,(H,20,24)
InChIKeyXZWDBGMLYUZIJI-UHFFFAOYSA-N
XLogP3.81
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide 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

N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide
CID 2928882
N-{4-[(2-phenylacetyl)amino]phenyl}-2-thiophenecarboxamide
CID 3162290
N-(1-benzothiophen-5-yl)-2-methylsulfonylbenzamide
CID 7267028
N-phenyl-1-benzothiophene-2-carboxamide
CID 237071
N-hydroxy-5-(naphthalene-1-carbonylamino)-1-benzothiophene-2-carboxamide
CID 11233783
N-hydroxy-6-(2-phenylacetamido)benzo[b]thiophene-2-carboxamide
CID 11255848
N-hydroxy-5-(2-phenylacetamido)benzo[b]thiophene-2-carboxamide
CID 11267357
N-hydroxy-6-(3-phenylpropanamido)benzo[b]thiophene-2-carboxamide
CID 11359758
6-benzamido-N-hydroxybenzo[b]thiophene-2-carboxamide
CID 11449785
5-Benzoylamino-benzo[b]thiophene-2-carboxylic acid hydroxyamide
CID 11461110
2-N-hydroxy-5-N-phenyl-1-benzothiophene-2,5-dicarboxamide
CID 44457049
N-[3-[[2-(diethylaminomethyl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 150210535

Frequently Asked Questions

What is the IUPAC name of N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide (CID 3632857) is N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide is O=C(Nc1ccc2sccc2c1)c1cccc(N2C(=O)CCC2=O)c1.
What is the InChIKey of N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide?
The InChIKey is XZWDBGMLYUZIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O3S/c22-17-6-7-18(23)21(17)15-3-1-2-13(11-15)19(24)20-14-4-5-16-12(10-14)8-9-25-16/h1-5,8-11H,6-7H2,(H,20,24).
What are the key properties of N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide?
N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide has a molecular weight of 350.40 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 3632857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).