2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide

C20H20ClN3O4S — CID 16935813

IUPAC2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide
SMILESO=C(Cn1cc(S(=O)(=O)c2ccc(Cl)cc2)c2ccccc21)NN1CCOCC1
InChIInChI=1S/C20H20ClN3O4S/c21-15-5-7-16(8-6-15)29(26,27)19-13-23(18-4-2-1-3-17(18)19)14-20(25)22-24-9-11-28-12-10-24/h1-8,13H,9-12,14H2,(H,22,25)
InChIKeySGYCIUGZXBAQRP-UHFFFAOYSA-N
MW433.92 g/mol
LogP2.49
Rot. Bonds5

About 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide

2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide (PubChem CID 16935813) has the molecular formula C20H20ClN3O4S and a molecular weight of 433.92 g/mol. Its IUPAC name is 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide.

Molecular Properties

Compound Name2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide
PubChem CID16935813
Molecular FormulaC20H20ClN3O4S
Molecular Weight433.92 g/mol
Exact Mass433.09
IUPAC Name2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide
SMILESO=C(Cn1cc(S(=O)(=O)c2ccc(Cl)cc2)c2ccccc21)NN1CCOCC1
InChIInChI=1S/C20H20ClN3O4S/c21-15-5-7-16(8-6-15)29(26,27)19-13-23(18-4-2-1-3-17(18)19)14-20(25)22-24-9-11-28-12-10-24/h1-8,13H,9-12,14H2,(H,22,25)
InChIKeySGYCIUGZXBAQRP-UHFFFAOYSA-N
XLogP2.49
TPSA80.64 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.92
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-tert-butyl-2-[3-(4-chlorophenyl)sulfonylindol-1-yl]acetamide
CID 16935764
1-(azepan-1-yl)-2-[3-(4-chlorophenyl)sulfonylindol-1-yl]ethanone
CID 16935724
N-benzhydryl-2-[3-(4-chlorophenyl)sulfonylindol-1-yl]acetamide
CID 30554059
2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-(oxolan-2-ylmethyl)acetamide
CID 16935785
2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-(2,3-dimethylphenyl)acetamide
CID 16935862
2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide
CID 16935809
2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone
CID 16935745
N-(5-chloro-2-methylphenyl)-2-[3-(4-methylphenyl)sulfonylindol-1-yl]acetamide
CID 16935677
N-[(2-chlorophenyl)methyl]-2-[3-(4-fluorophenyl)sulfonylindol-1-yl]acetamide
CID 16935990
N-(3-chlorophenyl)-2-[3-(4-fluorophenyl)sulfonylindol-1-yl]acetamide
CID 16936042
N-tert-butyl-2-[3-(4-fluorophenyl)sulfonylindol-1-yl]acetamide
CID 16935963
N-benzyl-2-[3-(4-methylphenyl)sulfonylindol-1-yl]acetamide
CID 16935583

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide?
The IUPAC name of 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide (CID 16935813) is 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide.
What is the SMILES notation for 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide?
The canonical SMILES for 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide is O=C(Cn1cc(S(=O)(=O)c2ccc(Cl)cc2)c2ccccc21)NN1CCOCC1.
What is the InChIKey of 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide?
The InChIKey is SGYCIUGZXBAQRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClN3O4S/c21-15-5-7-16(8-6-15)29(26,27)19-13-23(18-4-2-1-3-17(18)19)14-20(25)22-24-9-11-28-12-10-24/h1-8,13H,9-12,14H2,(H,22,25).
What are the key properties of 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide?
2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide has a molecular weight of 433.92 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-chlorophenyl)sulfonylindol-1-yl]-N-morpholin-4-ylacetamide is sourced from PubChem (CID 16935813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).