2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide

C11H13NO2S — CID 11708381

IUPAC2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide
SMILESNC(=O)CS(=O)C1CCc2ccccc21
InChIInChI=1S/C11H13NO2S/c12-11(13)7-15(14)10-6-5-8-3-1-2-4-9(8)10/h1-4,10H,5-7H2,(H2,12,13)
InChIKeyQKQWFAWTNZVSFM-UHFFFAOYSA-N
MW223.30 g/mol
LogP0.91
Rot. Bonds3

About 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide

2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide (PubChem CID 11708381) has the molecular formula C11H13NO2S and a molecular weight of 223.30 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide
PubChem CID11708381
Molecular FormulaC11H13NO2S
Molecular Weight223.30 g/mol
Exact Mass223.07
IUPAC Name2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide
SMILESNC(=O)CS(=O)C1CCc2ccccc21
InChIInChI=1S/C11H13NO2S/c12-11(13)7-15(14)10-6-5-8-3-1-2-4-9(8)10/h1-4,10H,5-7H2,(H2,12,13)
InChIKeyQKQWFAWTNZVSFM-UHFFFAOYSA-N
XLogP0.91
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide (CID 11708381) is 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide is NC(=O)CS(=O)C1CCc2ccccc21.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide?
The InChIKey is QKQWFAWTNZVSFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2S/c12-11(13)7-15(14)10-6-5-8-3-1-2-4-9(8)10/h1-4,10H,5-7H2,(H2,12,13).
What are the key properties of 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide?
2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide has a molecular weight of 223.30 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-1-ylsulfinyl)acetamide is sourced from PubChem (CID 11708381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).