4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide

C19H19NO3S — CID 26543228

IUPAC4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NCCOc2ccc3ccccc3c2)cc1
InChIInChI=1S/C19H19NO3S/c1-15-6-10-19(11-7-15)24(21,22)20-12-13-23-18-9-8-16-4-2-3-5-17(16)14-18/h2-11,14,20H,12-13H2,1H3
InChIKeyXHVFEYIKSUVWGJ-UHFFFAOYSA-N
MW341.43 g/mol
LogP3.51
Rot. Bonds6

About 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide

4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide (PubChem CID 26543228) has the molecular formula C19H19NO3S and a molecular weight of 341.43 g/mol. Its IUPAC name is 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide
PubChem CID26543228
Molecular FormulaC19H19NO3S
Molecular Weight341.43 g/mol
Exact Mass341.11
IUPAC Name4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NCCOc2ccc3ccccc3c2)cc1
InChIInChI=1S/C19H19NO3S/c1-15-6-10-19(11-7-15)24(21,22)20-12-13-23-18-9-8-16-4-2-3-5-17(16)14-18/h2-11,14,20H,12-13H2,1H3
InChIKeyXHVFEYIKSUVWGJ-UHFFFAOYSA-N
XLogP3.51
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(3-ethylphenoxy)ethyl]-4-methylbenzenesulfonamide
CID 113100033
N-[2-(3,5-dimethylphenoxy)ethyl]benzenesulfonamide
CID 30365872
4-methylbenzenesulfonic acid;3-naphthalen-2-yloxypropan-1-ol
CID 71444206
N-[4-[2-(4-methylphenoxy)ethylsulfamoyl]phenyl]acetamide
CID 2604521
4-amino-N-[2-(3-methylphenoxy)ethyl]benzenesulfonamide
CID 9158032
N-(2-naphthalen-2-yloxyethyl)-2-nitrobenzenesulfonamide
CID 26543227
2,5-dimethoxy-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide
CID 35395703
4-amino-N-[2-(3,4-dimethylphenoxy)ethyl]benzenesulfonamide
CID 9157907
4-tert-butyl-N-[2-(3-methylphenoxy)ethyl]benzenesulfonamide
CID 113099165
N-[2-(3-bromophenoxy)ethyl]-4-methoxybenzenesulfonamide
CID 113099676
N-(2-naphthalen-2-yloxyethyl)ethenesulfonamide
CID 86298279
N-[3-(4-cyanophenoxy)propyl]-4-methylbenzenesulfonamide
CID 177415345

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide?
The IUPAC name of 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide (CID 26543228) is 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide?
The canonical SMILES for 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide is Cc1ccc(S(=O)(=O)NCCOc2ccc3ccccc3c2)cc1.
What is the InChIKey of 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide?
The InChIKey is XHVFEYIKSUVWGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3S/c1-15-6-10-19(11-7-15)24(21,22)20-12-13-23-18-9-8-16-4-2-3-5-17(16)14-18/h2-11,14,20H,12-13H2,1H3.
What are the key properties of 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide?
4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide has a molecular weight of 341.43 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-naphthalen-2-yloxyethyl)benzenesulfonamide is sourced from PubChem (CID 26543228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).