2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide

C18H20N2O5S — CID 4791599

IUPAC2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide
SMILESCOc1ccc(NC(=O)COc2ccc3c(c2)CCC3)cc1S(N)(=O)=O
InChIInChI=1S/C18H20N2O5S/c1-24-16-8-6-14(10-17(16)26(19,22)23)20-18(21)11-25-15-7-5-12-3-2-4-13(12)9-15/h5-10H,2-4,11H2,1H3,(H,20,21)(H2,19,22,23)
InChIKeyAFWDNHKTXHJLEH-UHFFFAOYSA-N
MW376.43 g/mol
LogP1.85
Rot. Bonds6

About 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide

2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide (PubChem CID 4791599) has the molecular formula C18H20N2O5S and a molecular weight of 376.43 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide
PubChem CID4791599
Molecular FormulaC18H20N2O5S
Molecular Weight376.43 g/mol
Exact Mass376.11
IUPAC Name2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide
SMILESCOc1ccc(NC(=O)COc2ccc3c(c2)CCC3)cc1S(N)(=O)=O
InChIInChI=1S/C18H20N2O5S/c1-24-16-8-6-14(10-17(16)26(19,22)23)20-18(21)11-25-15-7-5-12-3-2-4-13(12)9-15/h5-10H,2-4,11H2,1H3,(H,20,21)(H2,19,22,23)
InChIKeyAFWDNHKTXHJLEH-UHFFFAOYSA-N
XLogP1.85
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.43
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide (CID 4791599) is 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide is COc1ccc(NC(=O)COc2ccc3c(c2)CCC3)cc1S(N)(=O)=O.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
The InChIKey is AFWDNHKTXHJLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5S/c1-24-16-8-6-14(10-17(16)26(19,22)23)20-18(21)11-25-15-7-5-12-3-2-4-13(12)9-15/h5-10H,2-4,11H2,1H3,(H,20,21)(H2,19,22,23).
What are the key properties of 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide?
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide has a molecular weight of 376.43 g/mol, XLogP of 1.85, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide is sourced from PubChem (CID 4791599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).