3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide

C19H19ClN2O3S — CID 2108565

IUPAC3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILESO=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C19H19ClN2O3S/c20-15-5-7-16(8-6-15)26(24,25)12-10-19(23)21-11-9-14-13-22-18-4-2-1-3-17(14)18/h1-8,13,22H,9-12H2,(H,21,23)
InChIKeyUJCXPSFFLASBQL-UHFFFAOYSA-N
MW390.89 g/mol
LogP3.34
Rot. Bonds7

About 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide

3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide (PubChem CID 2108565) has the molecular formula C19H19ClN2O3S and a molecular weight of 390.89 g/mol. Its IUPAC name is 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide
PubChem CID2108565
Molecular FormulaC19H19ClN2O3S
Molecular Weight390.89 g/mol
Exact Mass390.08
IUPAC Name3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide
SMILESO=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C19H19ClN2O3S/c20-15-5-7-16(8-6-15)26(24,25)12-10-19(23)21-11-9-14-13-22-18-4-2-1-3-17(14)18/h1-8,13,22H,9-12H2,(H,21,23)
InChIKeyUJCXPSFFLASBQL-UHFFFAOYSA-N
XLogP3.34
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.89
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[3-[2-(1H-indol-3-yl)ethylamino]-3-oxopropyl]benzamide
CID 26710991
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
(2S)-2-[3-(4-fluorophenyl)sulfonylpropanoylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 42571227
3-(dimethylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
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N-[2-(4-chlorophenyl)ethyl]-4-(1H-indol-3-yl)butanamide
CID 4796028
3-chloro-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 588711
N-[2-(1H-indol-3-yl)ethyl]-3-pyrrolidin-1-ylsulfonylpropanamide
CID 110342531
4-[2-(1H-indol-3-yl)ethylamino]-4-oxobutanoate
CID 7019224
3-(benzenesulfonamido)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 27644763
3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 18107802
N-[2-(4-chlorophenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 2114473
6-amino-N-[2-(1H-indol-3-yl)ethyl]hexanamide
CID 61259839

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The IUPAC name of 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide (CID 2108565) is 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The canonical SMILES for 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide is O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCCc1c[nH]c2ccccc12.
What is the InChIKey of 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The InChIKey is UJCXPSFFLASBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O3S/c20-15-5-7-16(8-6-15)26(24,25)12-10-19(23)21-11-9-14-13-22-18-4-2-1-3-17(14)18/h1-8,13,22H,9-12H2,(H,21,23).
What are the key properties of 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide?
3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide has a molecular weight of 390.89 g/mol, XLogP of 3.34, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)sulfonyl-N-[2-(1H-indol-3-yl)ethyl]propanamide is sourced from PubChem (CID 2108565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).