2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide

C17H18N2O3S — CID 110730109

IUPAC2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)NCCN1C(=O)Cc2ccccc21
InChIInChI=1S/C17H18N2O3S/c1-13-6-2-5-9-16(13)23(21,22)18-10-11-19-15-8-4-3-7-14(15)12-17(19)20/h2-9,18H,10-12H2,1H3
InChIKeySQNQKEIMVDZFIO-UHFFFAOYSA-N
MW330.41 g/mol
LogP1.86
Rot. Bonds5

About 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide

2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide (PubChem CID 110730109) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide
PubChem CID110730109
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC Name2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)NCCN1C(=O)Cc2ccccc21
InChIInChI=1S/C17H18N2O3S/c1-13-6-2-5-9-16(13)23(21,22)18-10-11-19-15-8-4-3-7-14(15)12-17(19)20/h2-9,18H,10-12H2,1H3
InChIKeySQNQKEIMVDZFIO-UHFFFAOYSA-N
XLogP1.86
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]thiophene-2-sulfonamide
CID 110730099
4-fluoro-3-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide
CID 110730096
1-(4-methylphenyl)-N-[2-(2-oxo-3H-indol-1-yl)ethyl]methanesulfonamide
CID 110730104
N-[2-(2-oxo-3H-indol-1-yl)ethyl]thiophene-2-sulfonamide
CID 110730098
N-[2-(2-oxo-3,4-dihydroquinolin-1-yl)ethyl]methanesulfonamide
CID 110729989
2-methyl-N-(2-thiomorpholin-4-ylethyl)benzenesulfonamide
CID 113248054
3,4-dimethyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzamide
CID 110730027
1-[3-(2-methylpropylamino)propyl]-3H-indol-2-one
CID 114993317
2-(3-methylphenyl)-N-[2-(2-oxo-3H-indol-1-yl)ethyl]acetamide
CID 110730070
2-methyl-N-(3-pyrrol-1-ylpropyl)benzenesulfonamide
CID 110721152
1-(3-chloro-4-fluorophenyl)-N-[2-(2-oxo-3H-indol-1-yl)ethyl]methanesulfonamide
CID 126769243
1-(2-methoxyethyl)-3H-indol-2-one
CID 58486241

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide?
The IUPAC name of 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide (CID 110730109) is 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide is Cc1ccccc1S(=O)(=O)NCCN1C(=O)Cc2ccccc21.
What is the InChIKey of 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide?
The InChIKey is SQNQKEIMVDZFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S/c1-13-6-2-5-9-16(13)23(21,22)18-10-11-19-15-8-4-3-7-14(15)12-17(19)20/h2-9,18H,10-12H2,1H3.
What are the key properties of 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide?
2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide has a molecular weight of 330.41 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(2-oxo-3H-indol-1-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 110730109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).