N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide

C14H19N3O5S — CID 112991190

IUPACN-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide
SMILESCOCCNC(=O)CNS(=O)(=O)c1ccc2c(c1)CC(=O)N2C
InChIInChI=1S/C14H19N3O5S/c1-17-12-4-3-11(7-10(12)8-14(17)19)23(20,21)16-9-13(18)15-5-6-22-2/h3-4,7,16H,5-6,8-9H2,1-2H3,(H,15,18)
InChIKeyNLCRRICIDUYGTF-UHFFFAOYSA-N
MW341.39 g/mol
LogP-0.75
Rot. Bonds7

About N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide

N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide (PubChem CID 112991190) has the molecular formula C14H19N3O5S and a molecular weight of 341.39 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide
PubChem CID112991190
Molecular FormulaC14H19N3O5S
Molecular Weight341.39 g/mol
Exact Mass341.10
IUPAC NameN-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide
SMILESCOCCNC(=O)CNS(=O)(=O)c1ccc2c(c1)CC(=O)N2C
InChIInChI=1S/C14H19N3O5S/c1-17-12-4-3-11(7-10(12)8-14(17)19)23(20,21)16-9-13(18)15-5-6-22-2/h3-4,7,16H,5-6,8-9H2,1-2H3,(H,15,18)
InChIKeyNLCRRICIDUYGTF-UHFFFAOYSA-N
XLogP-0.75
TPSA104.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 5-0.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-ethylphenyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide
CID 112996855
N-[2-(ethylamino)ethyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 62664588
1-methyl-2-oxo-N-(2-pyrrol-1-ylethyl)-3H-indole-5-sulfonamide
CID 110716372
2-[(3-bromophenyl)sulfonylamino]-N-(2-methoxyethyl)acetamide
CID 26543777
methyl 2,4-difluoro-5-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]benzoate
CID 24663091
1-methyl-N-(5-methylhexyl)-2-oxo-3H-indole-5-sulfonamide
CID 110672112
2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]oxyacetamide
CID 115992115
N-[2-(1,3-dioxan-2-yl)ethyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 110370188
N-cyclopropyl-2-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)sulfonylamino]acetamide
CID 110625100
N-[2-(2-ethylphenoxy)ethyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 113099946
N-[2-(2-fluorophenoxy)ethyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 113099232
N-[2-(2,4-dimethylphenoxy)ethyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 113100921

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide (CID 112991190) is N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide is COCCNC(=O)CNS(=O)(=O)c1ccc2c(c1)CC(=O)N2C.
What is the InChIKey of N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide?
The InChIKey is NLCRRICIDUYGTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O5S/c1-17-12-4-3-11(7-10(12)8-14(17)19)23(20,21)16-9-13(18)15-5-6-22-2/h3-4,7,16H,5-6,8-9H2,1-2H3,(H,15,18).
What are the key properties of N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide?
N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide has a molecular weight of 341.39 g/mol, XLogP of -0.75, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]acetamide is sourced from PubChem (CID 112991190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).