N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide

C17H17N3O4S — CID 142032429

IUPACN-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide
SMILESCNS(=O)(=O)c1ccc2ccn(C(=O)Nc3ccc(OC)cc3)c2c1
InChIInChI=1S/C17H17N3O4S/c1-18-25(22,23)15-8-3-12-9-10-20(16(12)11-15)17(21)19-13-4-6-14(24-2)7-5-13/h3-11,18H,1-2H3,(H,19,21)
InChIKeyPFAZRDFCPDQRNP-UHFFFAOYSA-N
MW359.41 g/mol
LogP2.64
Rot. Bonds4

About N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide

N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide (PubChem CID 142032429) has the molecular formula C17H17N3O4S and a molecular weight of 359.41 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide
PubChem CID142032429
Molecular FormulaC17H17N3O4S
Molecular Weight359.41 g/mol
Exact Mass359.09
IUPAC NameN-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide
SMILESCNS(=O)(=O)c1ccc2ccn(C(=O)Nc3ccc(OC)cc3)c2c1
InChIInChI=1S/C17H17N3O4S/c1-18-25(22,23)15-8-3-12-9-10-20(16(12)11-15)17(21)19-13-4-6-14(24-2)7-5-13/h3-11,18H,1-2H3,(H,19,21)
InChIKeyPFAZRDFCPDQRNP-UHFFFAOYSA-N
XLogP2.64
TPSA89.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.41
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methoxy-N-(4-methoxyphenyl)indole-1-carboxamide
CID 173299571
N-(4-methoxyphenyl)-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 27228930
N-(4-methoxyphenyl)-4-(4-methoxyphenyl)sulfonylpiperazine-1-carboxamide
CID 6470039
[2-(4-methoxyanilino)-2-oxoethyl] 2-fluoro-5-(methylsulfamoyl)benzoate
CID 18085306
[1-(4-methoxyanilino)-1-oxopropan-2-yl] 2-fluoro-5-(methylsulfamoyl)benzoate
CID 18091862
4-(3,4-dimethylphenyl)sulfonyl-N-(4-methoxyphenyl)piperazine-1-carboxamide
CID 46457488
N-[4-[(4-methoxyphenyl)sulfonylamino]phenyl]-2-methylpropanamide
CID 26965582
(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 9042158
N-(4-fluorophenyl)-4-(4-methoxyphenyl)sulfonylpiperazine-1-carboxamide
CID 6468041
N-(4-methoxyphenyl)-3-(2-methylpropylamino)-5-(methylsulfamoyl)benzamide
CID 26142268
4-(4-methoxyphenyl)sulfonyl-N-phenylpiperazine-1-carboxamide
CID 110637834
N'-[2-hydroxy-4-[(4-methoxyphenyl)sulfamoyl]phenyl]-N-(4-methoxyphenyl)oxamide
CID 20969932

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide (CID 142032429) is N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide is CNS(=O)(=O)c1ccc2ccn(C(=O)Nc3ccc(OC)cc3)c2c1.
What is the InChIKey of N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide?
The InChIKey is PFAZRDFCPDQRNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O4S/c1-18-25(22,23)15-8-3-12-9-10-20(16(12)11-15)17(21)19-13-4-6-14(24-2)7-5-13/h3-11,18H,1-2H3,(H,19,21).
What are the key properties of N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide?
N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide has a molecular weight of 359.41 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-6-(methylsulfamoyl)indole-1-carboxamide is sourced from PubChem (CID 142032429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).