1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone

C14H16N2O2S — CID 110746136

IUPAC1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone
SMILESCC(=O)c1ccc2c(c1)CCN2C(=O)C1CSCN1
InChIInChI=1S/C14H16N2O2S/c1-9(17)10-2-3-13-11(6-10)4-5-16(13)14(18)12-7-19-8-15-12/h2-3,6,12,15H,4-5,7-8H2,1H3
InChIKeySZKQJQDAIMQBPT-UHFFFAOYSA-N
MW276.36 g/mol
LogP1.44
Rot. Bonds2

About 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone

1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone (PubChem CID 110746136) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone.

Molecular Properties

Compound Name1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone
PubChem CID110746136
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone
SMILESCC(=O)c1ccc2c(c1)CCN2C(=O)C1CSCN1
InChIInChI=1S/C14H16N2O2S/c1-9(17)10-2-3-13-11(6-10)4-5-16(13)14(18)12-7-19-8-15-12/h2-3,6,12,15H,4-5,7-8H2,1H3
InChIKeySZKQJQDAIMQBPT-UHFFFAOYSA-N
XLogP1.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone 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

(6-chloro-3,4-dihydro-2H-quinolin-1-yl)-(1,3-thiazolidin-4-yl)methanone
CID 110742338
(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(1,3-thiazolidin-4-yl)methanone
CID 110742319
1-[3-fluoro-4-[4-(1,3-thiazolidine-4-carbonyl)piperazin-1-yl]phenyl]ethanone
CID 119837015
1-[(2S)-pyrrolidine-2-carbonyl]-2,3-dihydroindole-5-carboxylic acid
CID 61157412
1-[1-(4-bromobenzoyl)-2,3-dihydroindol-5-yl]ethanone
CID 110737345
1-[1-(cyclohexanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]ethanone
CID 110737681
1-(pyrrolidine-2-carbonyl)-3,4-dihydro-2H-quinoline-6-carboxylic acid
CID 61157415
ethane;1-(1-methyl-2,3-dihydroindol-5-yl)ethanone
CID 91428758
1-[1-[4-(dimethylamino)benzoyl]-2,3-dihydroindol-5-yl]ethanone
CID 110746141
1-[1-(3,5-dimethoxybenzoyl)-2,3-dihydroindol-5-yl]ethanone
CID 110737350
1-[1-(5-aminofuran-2-carbonyl)-2,3-dihydroindol-5-yl]ethanone
CID 82344236
(4-hydroxy-4-methyl-2,3-dihydroquinolin-1-yl)-(1,3-thiazolidin-4-yl)methanone
CID 110741432

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone?
The IUPAC name of 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone (CID 110746136) is 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone.
What is the SMILES notation for 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone?
The canonical SMILES for 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone is CC(=O)c1ccc2c(c1)CCN2C(=O)C1CSCN1.
What is the InChIKey of 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone?
The InChIKey is SZKQJQDAIMQBPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-9(17)10-2-3-13-11(6-10)4-5-16(13)14(18)12-7-19-8-15-12/h2-3,6,12,15H,4-5,7-8H2,1H3.
What are the key properties of 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone?
1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone has a molecular weight of 276.36 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1,3-thiazolidine-4-carbonyl)-2,3-dihydroindol-5-yl]ethanone is sourced from PubChem (CID 110746136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).