2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide

C17H17N3O3S — CID 9140853

IUPAC2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1S(N)(=O)=O
InChIInChI=1S/C17H17N3O3S/c1-11-6-7-13(9-16(11)24(18,22)23)20-17(21)8-12-10-19-15-5-3-2-4-14(12)15/h2-7,9-10,19H,8H2,1H3,(H,20,21)(H2,18,22,23)
InChIKeyBXJHGAIOVSCYEE-UHFFFAOYSA-N
MW343.41 g/mol
LogP2.30
Rot. Bonds4

About 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide

2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide (PubChem CID 9140853) has the molecular formula C17H17N3O3S and a molecular weight of 343.41 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
PubChem CID9140853
Molecular FormulaC17H17N3O3S
Molecular Weight343.41 g/mol
Exact Mass343.10
IUPAC Name2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1S(N)(=O)=O
InChIInChI=1S/C17H17N3O3S/c1-11-6-7-13(9-16(11)24(18,22)23)20-17(21)8-12-10-19-15-5-3-2-4-14(12)15/h2-7,9-10,19H,8H2,1H3,(H,20,21)(H2,18,22,23)
InChIKeyBXJHGAIOVSCYEE-UHFFFAOYSA-N
XLogP2.30
TPSA105.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.41
LogP ≤ 52.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 112998163
N-(3,4-dihydroxyphenyl)-2-(1H-indol-3-yl)acetamide
CID 170716792
N-(2,3-dimethylquinoxalin-6-yl)-2-(1H-indol-3-yl)acetamide
CID 110743801
2-(1H-indol-3-yl)-N-(3-methyl-2-oxo-1H-quinolin-7-yl)acetamide
CID 110427960
2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 18277249
N-[3-[(2-chlorophenyl)sulfamoyl]-4-methylphenyl]-3-(1H-indol-3-yl)propanamide
CID 26761049
N-(4-bromophenyl)-2-(1H-indol-3-yl)acetamide
CID 2093840
2-(1H-indol-3-yl)-N-[3-(methylcarbamoylamino)phenyl]acetamide
CID 38160633
N-(9-ethylcarbazol-3-yl)-2-(1H-indol-3-yl)acetamide
CID 2466222
N-[2-(4-acetylanilino)-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 112999594
N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide
CID 9140832
2-(1H-indol-3-yl)-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]acetamide
CID 112990361

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide (CID 9140853) is 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide is Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1S(N)(=O)=O.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The InChIKey is BXJHGAIOVSCYEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3S/c1-11-6-7-13(9-16(11)24(18,22)23)20-17(21)8-12-10-19-15-5-3-2-4-14(12)15/h2-7,9-10,19H,8H2,1H3,(H,20,21)(H2,18,22,23).
What are the key properties of 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide has a molecular weight of 343.41 g/mol, XLogP of 2.30, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide is sourced from PubChem (CID 9140853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).