3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide

C15H16N2O2S2 — CID 71879816

IUPAC3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
SMILESCN(C)C(=O)C1CSCN1C(=O)c1cc2ccccc2s1
InChIInChI=1S/C15H16N2O2S2/c1-16(2)14(18)11-8-20-9-17(11)15(19)13-7-10-5-3-4-6-12(10)21-13/h3-7,11H,8-9H2,1-2H3
InChIKeyRLAXJBKDVDGFJK-UHFFFAOYSA-N
MW320.44 g/mol
LogP2.50
Rot. Bonds2

About 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide

3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide (PubChem CID 71879816) has the molecular formula C15H16N2O2S2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
PubChem CID71879816
Molecular FormulaC15H16N2O2S2
Molecular Weight320.44 g/mol
Exact Mass320.07
IUPAC Name3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
SMILESCN(C)C(=O)C1CSCN1C(=O)c1cc2ccccc2s1
InChIInChI=1S/C15H16N2O2S2/c1-16(2)14(18)11-8-20-9-17(11)15(19)13-7-10-5-3-4-6-12(10)21-13/h3-7,11H,8-9H2,1-2H3
InChIKeyRLAXJBKDVDGFJK-UHFFFAOYSA-N
XLogP2.50
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide 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

1-(1-benzothiophene-2-carbonyl)-N,N-dimethylpiperidine-4-carboxamide
CID 78804876
3-(5-fluoro-1-benzothiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 43172251
(4R)-3-(2,3-dichlorobenzoyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
CID 95174306
(2R)-1-(1-benzothiophene-2-carbonyl)piperidine-2-carboxylic acid
CID 51888539
1-benzothiophen-2-yl-(2,4-dimethylpiperazin-1-yl)methanone
CID 71877088
1-benzothiophen-2-yl-[(3R,4S)-3,4-dihydroxypyrrolidin-1-yl]methanone
CID 79403286
bis(1-benzothiophen-2-yl)methanone
CID 5330534
3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
CID 75434211
1-(1-benzothiophene-2-carbonyl)-4-methoxypyrrolidine-2-carboxylic acid
CID 43172308
3-(thieno[3,2-b]thiophene-5-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 80733741
(4S)-N,N-dimethyl-3-(5-nitrofuran-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 95174309
1-(1-benzothiophene-2-carbonyl)-2-methylpiperidine-4-carboxylic acid
CID 106741898

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide?
The IUPAC name of 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide (CID 71879816) is 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide is CN(C)C(=O)C1CSCN1C(=O)c1cc2ccccc2s1.
What is the InChIKey of 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide?
The InChIKey is RLAXJBKDVDGFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S2/c1-16(2)14(18)11-8-20-9-17(11)15(19)13-7-10-5-3-4-6-12(10)21-13/h3-7,11H,8-9H2,1-2H3.
What are the key properties of 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide?
3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide has a molecular weight of 320.44 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 71879816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).