N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide

C18H17ClN2O3S — CID 15998973

IUPACN-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2C)c2cccnc12
InChIInChI=1S/C18H17ClN2O3S/c1-3-24-16-8-9-17(14-5-4-10-20-18(14)16)25(22,23)21-15-11-13(19)7-6-12(15)2/h4-11,21H,3H2,1-2H3
InChIKeyPUYCUBKOEYUYKO-UHFFFAOYSA-N
MW376.87 g/mol
LogP4.40
Rot. Bonds5

About N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide

N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide (PubChem CID 15998973) has the molecular formula C18H17ClN2O3S and a molecular weight of 376.87 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide
PubChem CID15998973
Molecular FormulaC18H17ClN2O3S
Molecular Weight376.87 g/mol
Exact Mass376.06
IUPAC NameN-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2C)c2cccnc12
InChIInChI=1S/C18H17ClN2O3S/c1-3-24-16-8-9-17(14-5-4-10-20-18(14)16)25(22,23)21-15-11-13(19)7-6-12(15)2/h4-11,21H,3H2,1-2H3
InChIKeyPUYCUBKOEYUYKO-UHFFFAOYSA-N
XLogP4.40
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.87
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(8-ethoxyquinolin-5-yl)sulfonylamino]benzamide
CID 25035028
N-(5-chloro-2-ethoxyphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299319
N-(5-bromo-6-methyl-2-pyridinyl)-8-ethoxyquinoline-5-sulfonamide
CID 25038226
4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide
CID 165435904
8-ethoxy-N-[2-(2-ethoxyphenyl)ethyl]quinoline-5-sulfonamide
CID 3684734
8-ethoxy-N-[3-(trifluoromethoxy)phenyl]quinoline-5-sulfonamide
CID 5186150
8-ethoxy-N-[2-(4-ethoxy-3-methoxyphenyl)ethyl]quinoline-5-sulfonamide
CID 3869525
8-Ethoxy-5-quinolinesulfonic acid sodium salt monohydrate
CID 45157436
2-ethoxy-4-methyl-N-quinolin-8-ylbenzenesulfonamide
CID 76506701
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-8-ethoxyquinoline-5-sulfonamide
CID 12060450
8-fluoro-N-(2-methoxy-4-methylphenyl)quinoline-5-sulfonamide
CID 60534314
N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide
CID 47310702

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide (CID 15998973) is N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide is CCOc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2C)c2cccnc12.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide?
The InChIKey is PUYCUBKOEYUYKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O3S/c1-3-24-16-8-9-17(14-5-4-10-20-18(14)16)25(22,23)21-15-11-13(19)7-6-12(15)2/h4-11,21H,3H2,1-2H3.
What are the key properties of N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide?
N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide has a molecular weight of 376.87 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide is sourced from PubChem (CID 15998973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).