5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine

C20H24N2OS — CID 141169067

IUPAC5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine
SMILESc1ccc2c(c1)CCN2CCOc1ccc(CC2CNCS2)cc1
InChIInChI=1S/C20H24N2OS/c1-2-4-20-17(3-1)9-10-22(20)11-12-23-18-7-5-16(6-8-18)13-19-14-21-15-24-19/h1-8,19,21H,9-15H2
InChIKeyDMDOUWXZABFXCW-UHFFFAOYSA-N
MW340.49 g/mol
LogP3.33
Rot. Bonds6

About 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine

5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine (PubChem CID 141169067) has the molecular formula C20H24N2OS and a molecular weight of 340.49 g/mol. Its IUPAC name is 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine.

Molecular Properties

Compound Name5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine
PubChem CID141169067
Molecular FormulaC20H24N2OS
Molecular Weight340.49 g/mol
Exact Mass340.16
IUPAC Name5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine
SMILESc1ccc2c(c1)CCN2CCOc1ccc(CC2CNCS2)cc1
InChIInChI=1S/C20H24N2OS/c1-2-4-20-17(3-1)9-10-22(20)11-12-23-18-7-5-16(6-8-18)13-19-14-21-15-24-19/h1-8,19,21H,9-15H2
InChIKeyDMDOUWXZABFXCW-UHFFFAOYSA-N
XLogP3.33
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.49
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-fluorophenoxy)ethyl]-2,3-dihydroindole
CID 82089229
5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-4-hydroxy-3H-1,3-thiazol-2-one
CID 54418802
N-methyl-N-[2-[4-(1,3-thiazolidin-5-ylmethyl)phenoxy]ethyl]pyrimidin-2-amine
CID 140996588
2-benzyl-7-[2-(2,3-dihydroindol-1-yl)ethoxy]-3,4-dihydro-1H-isoquinoline
CID 141038257
1-(2-piperazin-1-ylethyl)-2,3-dihydroindole
CID 28704454
5-[[4-[[(2S)-1-(4-methylquinolin-2-yl)pyrrolidin-2-yl]methoxy]phenyl]methyl]-1,3-thiazolidine
CID 140995182
[3-[C-methyl-N-[2-[4-(1,3-thiazolidin-5-ylmethyl)phenoxy]ethoxy]carbonimidoyl]phenyl] acetate
CID 139712877
N-[4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethoxy]phenyl]acetamide
CID 71912035
5-[[4-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
CID 22118748
2,3-dihydroindol-1-yl-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]methanone
CID 22390855
1-(2-iodoethyl)-2,3-dihydroindole
CID 131082836
2-(2,3-dihydroindol-1-yl)ethanamine
CID 1072384

Frequently Asked Questions

What is the IUPAC name of 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine?
The IUPAC name of 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine (CID 141169067) is 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine.
What is the SMILES notation for 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine?
The canonical SMILES for 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine is c1ccc2c(c1)CCN2CCOc1ccc(CC2CNCS2)cc1.
What is the InChIKey of 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine?
The InChIKey is DMDOUWXZABFXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2OS/c1-2-4-20-17(3-1)9-10-22(20)11-12-23-18-7-5-16(6-8-18)13-19-14-21-15-24-19/h1-8,19,21H,9-15H2.
What are the key properties of 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine?
5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine has a molecular weight of 340.49 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-[2-(2,3-dihydroindol-1-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine is sourced from PubChem (CID 141169067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).