1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole

C20H19NO3S — CID 2956327

IUPAC1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole
SMILESCCOc1ccc(S(=O)(=O)N2CCc3ccccc32)c2ccccc12
InChIInChI=1S/C20H19NO3S/c1-2-24-19-11-12-20(17-9-5-4-8-16(17)19)25(22,23)21-14-13-15-7-3-6-10-18(15)21/h3-12H,2,13-14H2,1H3
InChIKeyUZNPJUTZOZVXJE-UHFFFAOYSA-N
MW353.44 g/mol
LogP3.99
Rot. Bonds4

About 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole

1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole (PubChem CID 2956327) has the molecular formula C20H19NO3S and a molecular weight of 353.44 g/mol. Its IUPAC name is 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole
PubChem CID2956327
Molecular FormulaC20H19NO3S
Molecular Weight353.44 g/mol
Exact Mass353.11
IUPAC Name1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole
SMILESCCOc1ccc(S(=O)(=O)N2CCc3ccccc32)c2ccccc12
InChIInChI=1S/C20H19NO3S/c1-2-24-19-11-12-20(17-9-5-4-8-16(17)19)25(22,23)21-14-13-15-7-3-6-10-18(15)21/h3-12H,2,13-14H2,1H3
InChIKeyUZNPJUTZOZVXJE-UHFFFAOYSA-N
XLogP3.99
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.44
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole with MolForge

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

Launch Full Analysis

Related Compounds

(2S,6S)-1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,6-dimethylpiperidine
CID 748027
(2R)-1-(4-ethoxynaphthalen-1-yl)sulfonyl-2-methylpiperidine
CID 760946
1-(5-bromo-2-methoxyphenyl)sulfonyl-2,3-dihydroindole
CID 3779020
4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)-N-(4-ethoxy-3-fluorophenyl)benzamide
CID 55916648
2-(4-ethoxy-2,3-dimethylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline
CID 4914550
1-[1-(4-ethoxynaphthalen-1-yl)sulfonylpiperidin-4-yl]ethanamine;hydrochloride
CID 119975042
1-(4-ethoxynaphthalen-1-yl)sulfonyl-4-(2,4,6-trimethylphenyl)piperazine
CID 91669820
[1-(4-ethoxynaphthalen-1-yl)sulfonylpyrrolidin-2-yl]methanamine;hydrochloride
CID 119988979
sodium;4-ethoxynaphthalene-1-sulfonic acid;hydride
CID 173109617
4-(2,3-dihydroindol-1-ylsulfonyl)-3-methoxy-N-(2-methylbutan-2-yl)benzamide
CID 140990194
1-(2,3,4-trichlorophenyl)sulfonyl-2,3-dihydroindole
CID 50876146
[1-(4-ethoxynaphthalen-1-yl)sulfonyl-3-methylpyrrolidin-3-yl]methanamine;hydrochloride
CID 120777569

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole?
The IUPAC name of 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole (CID 2956327) is 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole.
What is the SMILES notation for 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole?
The canonical SMILES for 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole is CCOc1ccc(S(=O)(=O)N2CCc3ccccc32)c2ccccc12.
What is the InChIKey of 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole?
The InChIKey is UZNPJUTZOZVXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO3S/c1-2-24-19-11-12-20(17-9-5-4-8-16(17)19)25(22,23)21-14-13-15-7-3-6-10-18(15)21/h3-12H,2,13-14H2,1H3.
What are the key properties of 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole?
1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole has a molecular weight of 353.44 g/mol, XLogP of 3.99, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindole is sourced from PubChem (CID 2956327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).