3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one

C15H18N2O3S — CID 24714607

IUPAC3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
SMILESCOCCN1C(=O)C2(SCCN2C(C)=O)c2ccccc21
InChIInChI=1S/C15H18N2O3S/c1-11(18)17-8-10-21-15(17)12-5-3-4-6-13(12)16(14(15)19)7-9-20-2/h3-6H,7-10H2,1-2H3
InChIKeyRQSLDSYPBIDMBB-UHFFFAOYSA-N
MW306.39 g/mol
LogP1.43
Rot. Bonds3

About 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one

3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one (PubChem CID 24714607) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one.

Molecular Properties

Compound Name3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
PubChem CID24714607
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC Name3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
SMILESCOCCN1C(=O)C2(SCCN2C(C)=O)c2ccccc21
InChIInChI=1S/C15H18N2O3S/c1-11(18)17-8-10-21-15(17)12-5-3-4-6-13(12)16(14(15)19)7-9-20-2/h3-6H,7-10H2,1-2H3
InChIKeyRQSLDSYPBIDMBB-UHFFFAOYSA-N
XLogP1.43
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopentanecarbonyl)-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 46017241
(2R)-3-acetyl-1'-[(2-fluorophenyl)methyl]spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 93185978
1'-[(3-fluorophenyl)methyl]-3-(2-methoxyacetyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 46016823
(2S)-3-(3-methoxybenzoyl)-1'-[(3-methoxyphenyl)methyl]spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 93186213
(2R)-1'-[(4-fluorophenyl)methyl]-3-(4-methoxybenzoyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 93180632
1'-[(4-methylphenyl)methyl]-3-(2-methylpropanoyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 42839177
1'-[(3-methoxyphenyl)methyl]-3-(thiophene-2-carbonyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 46016829
(2S)-1'-[(2-methylphenyl)methyl]-3-(thiophene-2-carbonyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 93180742
3-acetyl-1'-[(2-chlorophenyl)methyl]-5'-methylspiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 46016894
(2R)-1'-[(3-methylphenyl)methyl]-3-propanoylspiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 93186074
(2S)-1'-[(2,6-difluorophenyl)methyl]-3-(2-fluorobenzoyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 93187185
(2R)-3-(3-methoxybenzoyl)-1'-[(2-methylphenyl)methyl]spiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 93180777

Frequently Asked Questions

What is the IUPAC name of 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one?
The IUPAC name of 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one (CID 24714607) is 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one.
What is the SMILES notation for 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one?
The canonical SMILES for 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one is COCCN1C(=O)C2(SCCN2C(C)=O)c2ccccc21.
What is the InChIKey of 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one?
The InChIKey is RQSLDSYPBIDMBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-11(18)17-8-10-21-15(17)12-5-3-4-6-13(12)16(14(15)19)7-9-20-2/h3-6H,7-10H2,1-2H3.
What are the key properties of 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one?
3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one has a molecular weight of 306.39 g/mol, XLogP of 1.43, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetyl-1'-(2-methoxyethyl)spiro[1,3-thiazolidine-2,3'-indole]-2'-one is sourced from PubChem (CID 24714607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).