2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide

C19H20N2O3S — CID 2157576

IUPAC2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide
SMILESCCn1cc(S(=O)(=O)CC(=O)Nc2ccc(C)cc2)c2ccccc21
InChIInChI=1S/C19H20N2O3S/c1-3-21-12-18(16-6-4-5-7-17(16)21)25(23,24)13-19(22)20-15-10-8-14(2)9-11-15/h4-12H,3,13H2,1-2H3,(H,20,22)
InChIKeySAOCUWPHSJIXHX-UHFFFAOYSA-N
MW356.45 g/mol
LogP3.38
Rot. Bonds5

About 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide

2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide (PubChem CID 2157576) has the molecular formula C19H20N2O3S and a molecular weight of 356.45 g/mol. Its IUPAC name is 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide
PubChem CID2157576
Molecular FormulaC19H20N2O3S
Molecular Weight356.45 g/mol
Exact Mass356.12
IUPAC Name2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide
SMILESCCn1cc(S(=O)(=O)CC(=O)Nc2ccc(C)cc2)c2ccccc21
InChIInChI=1S/C19H20N2O3S/c1-3-21-12-18(16-6-4-5-7-17(16)21)25(23,24)13-19(22)20-15-10-8-14(2)9-11-15/h4-12H,3,13H2,1-2H3,(H,20,22)
InChIKeySAOCUWPHSJIXHX-UHFFFAOYSA-N
XLogP3.38
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide (CID 2157576) is 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide is CCn1cc(S(=O)(=O)CC(=O)Nc2ccc(C)cc2)c2ccccc21.
What is the InChIKey of 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide?
The InChIKey is SAOCUWPHSJIXHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3S/c1-3-21-12-18(16-6-4-5-7-17(16)21)25(23,24)13-19(22)20-15-10-8-14(2)9-11-15/h4-12H,3,13H2,1-2H3,(H,20,22).
What are the key properties of 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide?
2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide has a molecular weight of 356.45 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylindol-3-yl)sulfonyl-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 2157576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).