N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide

C17H16N2O4S — CID 22548568

IUPACN-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1
InChIInChI=1S/C17H16N2O4S/c1-2-23-16-6-4-3-5-15(16)19-24(21,22)13-8-9-14-12(11-13)7-10-17(20)18-14/h3-11,19H,2H2,1H3,(H,18,20)
InChIKeyBLWVRZAVPBLGAW-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.73
Rot. Bonds5

About N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide

N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide (PubChem CID 22548568) has the molecular formula C17H16N2O4S and a molecular weight of 344.39 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide
PubChem CID22548568
Molecular FormulaC17H16N2O4S
Molecular Weight344.39 g/mol
Exact Mass344.08
IUPAC NameN-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1
InChIInChI=1S/C17H16N2O4S/c1-2-23-16-6-4-3-5-15(16)19-24(21,22)13-8-9-14-12(11-13)7-10-17(20)18-14/h3-11,19H,2H2,1H3,(H,18,20)
InChIKeyBLWVRZAVPBLGAW-UHFFFAOYSA-N
XLogP2.73
TPSA88.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 155521462
N-(2-ethoxyphenyl)-6-morpholin-4-ylsulfonyl-2-oxo-1H-quinoline-4-carboxamide
CID 2463208
N-[4-[methyl-[4-[2-(3-methylphenoxy)ethoxy]phenyl]sulfamoyl]phenyl]acetamide
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3-{[(2-ethoxyanilino)carbonyl]amino}-N,N,4-trimethylbenzenesulfonamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide (CID 22548568) is N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide is CCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1.
What is the InChIKey of N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide?
The InChIKey is BLWVRZAVPBLGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O4S/c1-2-23-16-6-4-3-5-15(16)19-24(21,22)13-8-9-14-12(11-13)7-10-17(20)18-14/h3-11,19H,2H2,1H3,(H,18,20).
What are the key properties of N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide?
N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide has a molecular weight of 344.39 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-oxo-1H-quinoline-6-sulfonamide is sourced from PubChem (CID 22548568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).