4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide

C19H19NO3S — CID 165435904

IUPAC4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccccc2C)c2ccccc12
InChIInChI=1S/C19H19NO3S/c1-3-23-18-12-13-19(16-10-6-5-9-15(16)18)24(21,22)20-17-11-7-4-8-14(17)2/h4-13,20H,3H2,1-2H3
InChIKeyLJXDTRBEASDJRK-UHFFFAOYSA-N
MW341.43 g/mol
LogP4.35
Rot. Bonds5

About 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide

4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide (PubChem CID 165435904) has the molecular formula C19H19NO3S and a molecular weight of 341.43 g/mol. Its IUPAC name is 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide
PubChem CID165435904
Molecular FormulaC19H19NO3S
Molecular Weight341.43 g/mol
Exact Mass341.11
IUPAC Name4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccccc2C)c2ccccc12
InChIInChI=1S/C19H19NO3S/c1-3-23-18-12-13-19(16-10-6-5-9-15(16)18)24(21,22)20-17-11-7-4-8-14(17)2/h4-13,20H,3H2,1-2H3
InChIKeyLJXDTRBEASDJRK-UHFFFAOYSA-N
XLogP4.35
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-difluorophenyl)-4-ethoxynaphthalene-1-sulfonamide
CID 60579353
4-ethoxy-N-ethylnaphthalene-1-sulfonamide
CID 2235792
4-ethoxy-N-[2-(4-methyl-1,2,4-triazol-3-yl)phenyl]naphthalene-1-sulfonamide
CID 60579200
N-tert-butyl-4-ethoxynaphthalene-1-sulfonamide
CID 66485755
4-ethoxy-3-methyl-N-(2-methylphenyl)benzenesulfonamide
CID 4214214
N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide
CID 7742393
N-cyclobutyl-4-ethoxynaphthalene-1-sulfonamide
CID 172880543
2-[4-[(4-ethoxynaphthalen-1-yl)sulfonylamino]phenyl]acetate
CID 5046040
N-(5-chloro-2-methylphenyl)-8-ethoxyquinoline-5-sulfonamide
CID 15998973
N-(4-aminobutyl)-4-ethoxynaphthalene-1-sulfonamide
CID 120583247
N-[3-[(4-ethoxynaphthalen-1-yl)sulfonylamino]phenyl]-2-hydroxyacetamide
CID 56573661
sodium;4-ethoxynaphthalene-1-sulfonic acid;hydride
CID 173109617

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide?
The IUPAC name of 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide (CID 165435904) is 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide.
What is the SMILES notation for 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide?
The canonical SMILES for 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide is CCOc1ccc(S(=O)(=O)Nc2ccccc2C)c2ccccc12.
What is the InChIKey of 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide?
The InChIKey is LJXDTRBEASDJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3S/c1-3-23-18-12-13-19(16-10-6-5-9-15(16)18)24(21,22)20-17-11-7-4-8-14(17)2/h4-13,20H,3H2,1-2H3.
What are the key properties of 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide?
4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide has a molecular weight of 341.43 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(2-methylphenyl)naphthalene-1-sulfonamide is sourced from PubChem (CID 165435904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).