2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide

C17H24N2O5S — CID 110609079

IUPAC2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide
SMILESCOCCOCCS(=O)(=O)NCCc1cc2ccc(C)cc2[nH]c1=O
InChIInChI=1S/C17H24N2O5S/c1-13-3-4-14-12-15(17(20)19-16(14)11-13)5-6-18-25(21,22)10-9-24-8-7-23-2/h3-4,11-12,18H,5-10H2,1-2H3,(H,19,20)
InChIKeyGFDXOVPBHOSYFH-UHFFFAOYSA-N
MW368.46 g/mol
LogP0.96
Rot. Bonds10

About 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide

2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide (PubChem CID 110609079) has the molecular formula C17H24N2O5S and a molecular weight of 368.46 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide
PubChem CID110609079
Molecular FormulaC17H24N2O5S
Molecular Weight368.46 g/mol
Exact Mass368.14
IUPAC Name2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide
SMILESCOCCOCCS(=O)(=O)NCCc1cc2ccc(C)cc2[nH]c1=O
InChIInChI=1S/C17H24N2O5S/c1-13-3-4-14-12-15(17(20)19-16(14)11-13)5-6-18-25(21,22)10-9-24-8-7-23-2/h3-4,11-12,18H,5-10H2,1-2H3,(H,19,20)
InChIKeyGFDXOVPBHOSYFH-UHFFFAOYSA-N
XLogP0.96
TPSA97.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 50.96
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

1-(2-chlorophenyl)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]methanesulfonamide
CID 110325870
4-bromo-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]benzenesulfonamide
CID 4068078
3-acetyl-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]benzenesulfonamide
CID 110414998
N-[2-(2-fluorophenyl)ethyl]-2-(2-methoxyethoxy)ethanesulfonamide
CID 110411117
N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide
CID 110326068
N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-1-phenylmethanesulfonamide
CID 110325936
N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-nitrobenzenesulfonamide
CID 110325883
2,4-dichloro-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]benzamide
CID 4147135
N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-phenylbenzamide
CID 7080098
4-methyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 110324590
2,5-dimethyl-N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]benzenesulfonamide
CID 110325922
2-(2-methoxyethoxy)-N-(3-methyl-2-oxo-1H-quinolin-6-yl)ethanesulfonamide
CID 127265969

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide?
The IUPAC name of 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide (CID 110609079) is 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide?
The canonical SMILES for 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide is COCCOCCS(=O)(=O)NCCc1cc2ccc(C)cc2[nH]c1=O.
What is the InChIKey of 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide?
The InChIKey is GFDXOVPBHOSYFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O5S/c1-13-3-4-14-12-15(17(20)19-16(14)11-13)5-6-18-25(21,22)10-9-24-8-7-23-2/h3-4,11-12,18H,5-10H2,1-2H3,(H,19,20).
What are the key properties of 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide?
2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide has a molecular weight of 368.46 g/mol, XLogP of 0.96, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-[2-(7-methyl-2-oxo-1H-quinolin-3-yl)ethyl]ethanesulfonamide is sourced from PubChem (CID 110609079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).