2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide

C20H19ClN4O3S — CID 58584803

IUPAC2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide
SMILESCOCCN(C)S(=O)(=O)c1ccc2[nH]c(-c3nc4ccccc4nc3Cl)cc2c1
InChIInChI=1S/C20H19ClN4O3S/c1-25(9-10-28-2)29(26,27)14-7-8-15-13(11-14)12-18(22-15)19-20(21)24-17-6-4-3-5-16(17)23-19/h3-8,11-12,22H,9-10H2,1-2H3
InChIKeyIZNGNMVQEGTKEG-UHFFFAOYSA-N
MW430.92 g/mol
LogP3.70
Rot. Bonds6

About 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide

2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide (PubChem CID 58584803) has the molecular formula C20H19ClN4O3S and a molecular weight of 430.92 g/mol. Its IUPAC name is 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide.

Molecular Properties

Compound Name2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide
PubChem CID58584803
Molecular FormulaC20H19ClN4O3S
Molecular Weight430.92 g/mol
Exact Mass430.09
IUPAC Name2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide
SMILESCOCCN(C)S(=O)(=O)c1ccc2[nH]c(-c3nc4ccccc4nc3Cl)cc2c1
InChIInChI=1S/C20H19ClN4O3S/c1-25(9-10-28-2)29(26,27)14-7-8-15-13(11-14)12-18(22-15)19-20(21)24-17-6-4-3-5-16(17)23-19/h3-8,11-12,22H,9-10H2,1-2H3
InChIKeyIZNGNMVQEGTKEG-UHFFFAOYSA-N
XLogP3.70
TPSA88.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.92
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide with MolForge

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Related Compounds

N-(2-methoxyethyl)-N-methyl-2-phenyl-3H-benzimidazole-5-sulfonamide
CID 23936708
3-bromo-4-chloro-N-(2-methoxyethyl)-N-methylbenzenesulfonamide
CID 106545645
3-(1H-indol-2-yl)-6-[2-methoxyethyl(methyl)amino]-1H-quinoxalin-2-one
CID 58584670
6,7-difluoro-3-[5-[2-methoxyethyl(methyl)amino]-1H-indol-2-yl]-1H-quinoxalin-2-one
CID 58584936
N-(2-methoxyethyl)-N-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide
CID 140900815
2-chloro-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridine-3-sulfonamide
CID 47298945
3-chloro-N-(2-methoxyethyl)-N-methyl-4-(propylaminomethyl)benzenesulfonamide
CID 107091387
2-chloro-N-(2-methoxyethyl)-N-methyl-5-nitrobenzenesulfonamide
CID 61045808
N-[3-(1H-benzimidazol-2-yl)propyl]-4-chloro-N-methylbenzenesulfonamide
CID 1264970
N-(1H-benzimidazol-2-ylmethyl)-3,4-dimethoxy-N-methylbenzenesulfonamide
CID 35385496
methanesulfonic acid;3-[5-[2-[2-methoxyethyl(methyl)amino]ethoxy]-1H-indol-2-yl]-1H-quinolin-2-one
CID 10299900
3-(1-aminoethyl)-N-(2-methoxyethyl)-N-methylbenzenesulfonamide
CID 61428330

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide?
The IUPAC name of 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide (CID 58584803) is 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide.
What is the SMILES notation for 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide?
The canonical SMILES for 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide is COCCN(C)S(=O)(=O)c1ccc2[nH]c(-c3nc4ccccc4nc3Cl)cc2c1.
What is the InChIKey of 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide?
The InChIKey is IZNGNMVQEGTKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN4O3S/c1-25(9-10-28-2)29(26,27)14-7-8-15-13(11-14)12-18(22-15)19-20(21)24-17-6-4-3-5-16(17)23-19/h3-8,11-12,22H,9-10H2,1-2H3.
What are the key properties of 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide?
2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide has a molecular weight of 430.92 g/mol, XLogP of 3.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloroquinoxalin-2-yl)-N-(2-methoxyethyl)-N-methyl-1H-indole-5-sulfonamide is sourced from PubChem (CID 58584803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).