5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide

C17H16ClN3O3S — CID 10068194

IUPAC5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide
SMILESNC(=O)c1[nH]c2ccc(Cl)cc2c1S(=O)(=O)NCCc1ccccc1
InChIInChI=1S/C17H16ClN3O3S/c18-12-6-7-14-13(10-12)16(15(21-14)17(19)22)25(23,24)20-9-8-11-4-2-1-3-5-11/h1-7,10,20-21H,8-9H2,(H2,19,22)
InChIKeyLFZBJQJZWVNDTB-UHFFFAOYSA-N
MW377.85 g/mol
LogP2.44
Rot. Bonds6

About 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide

5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide (PubChem CID 10068194) has the molecular formula C17H16ClN3O3S and a molecular weight of 377.85 g/mol. Its IUPAC name is 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide
PubChem CID10068194
Molecular FormulaC17H16ClN3O3S
Molecular Weight377.85 g/mol
Exact Mass377.06
IUPAC Name5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide
SMILESNC(=O)c1[nH]c2ccc(Cl)cc2c1S(=O)(=O)NCCc1ccccc1
InChIInChI=1S/C17H16ClN3O3S/c18-12-6-7-14-13(10-12)16(15(21-14)17(19)22)25(23,24)20-9-8-11-4-2-1-3-5-11/h1-7,10,20-21H,8-9H2,(H2,19,22)
InChIKeyLFZBJQJZWVNDTB-UHFFFAOYSA-N
XLogP2.44
TPSA105.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.85
LogP ≤ 52.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-3-(propylsulfamoyl)-1H-indole-2-carboxamide
CID 10425860
5-chloro-3-[(3-chlorophenyl)methylsulfamoyl]-1H-indole-2-carboxamide
CID 67375248
5-chloro-3-(3-hydroxypropylsulfamoyl)-1H-indole-2-carboxamide
CID 90709499
1-chloro-4-methylbenzene;5-chloro-3-(methylsulfamoyl)-1H-indole-2-carboxamide
CID 162220092
5-chloro-3-(4-chlorophenyl)sulfonyl-1H-indole-2-carboxamide
CID 506869
5-chloro-3-[2-hydroxyethyl(methyl)sulfamoyl]-1H-indole-2-carboxamide
CID 10471920
2-(5-chloro-2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide
CID 113211952
6-(2-phenylethylsulfamoyl)-9H-pyrido[3,4-b]indole-1-carboxamide
CID 53380421
5-chloro-3-(2,4-dimethylphenyl)sulfonyl-1H-indole-2-carboxamide
CID 506872
5-chloro-3-methyl-1H-indole-2-carboxamide
CID 14567452
5-bromo-3-[2-[(5-bromo-2-methoxyphenyl)sulfonylamino]ethylsulfamoyl]-1H-indole-2-carboxamide
CID 10348762
3-(4-acetylpiperazin-1-yl)sulfonyl-5-chloro-1H-indole-2-carboxamide
CID 10068626

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide?
The IUPAC name of 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide (CID 10068194) is 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide?
The canonical SMILES for 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide is NC(=O)c1[nH]c2ccc(Cl)cc2c1S(=O)(=O)NCCc1ccccc1.
What is the InChIKey of 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide?
The InChIKey is LFZBJQJZWVNDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN3O3S/c18-12-6-7-14-13(10-12)16(15(21-14)17(19)22)25(23,24)20-9-8-11-4-2-1-3-5-11/h1-7,10,20-21H,8-9H2,(H2,19,22).
What are the key properties of 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide?
5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide has a molecular weight of 377.85 g/mol, XLogP of 2.44, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(2-phenylethylsulfamoyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 10068194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).