4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide

C18H17NO3S — CID 7938656

IUPAC4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc3ccccc3c2)cc1
InChIInChI=1S/C18H17NO3S/c1-2-22-17-9-11-18(12-10-17)23(20,21)19-16-8-7-14-5-3-4-6-15(14)13-16/h3-13,19H,2H2,1H3
InChIKeyVONIFXNYGOMTKN-UHFFFAOYSA-N
MW327.41 g/mol
LogP4.04
Rot. Bonds5

About 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide

4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide (PubChem CID 7938656) has the molecular formula C18H17NO3S and a molecular weight of 327.41 g/mol. Its IUPAC name is 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide
PubChem CID7938656
Molecular FormulaC18H17NO3S
Molecular Weight327.41 g/mol
Exact Mass327.09
IUPAC Name4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc3ccccc3c2)cc1
InChIInChI=1S/C18H17NO3S/c1-2-22-17-9-11-18(12-10-17)23(20,21)19-16-8-7-14-5-3-4-6-15(14)13-16/h3-13,19H,2H2,1H3
InChIKeyVONIFXNYGOMTKN-UHFFFAOYSA-N
XLogP4.04
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4202178
1-N-methyl-4-N-naphthalen-2-ylbenzene-1,4-disulfonamide
CID 86922484
N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-2-naphthalen-2-yloxybutanamide
CID 17106989
4-ethoxy-N-(4-methylphenyl)benzenesulfonamide
CID 925010
N-[4-(4-ethoxyanilino)phenyl]-4-methoxybenzenesulfonamide
CID 112987708
4-ethoxy-N-(3-fluoro-4-methylphenyl)benzenesulfonamide
CID 2121784
4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide
CID 848328
4-[(4-ethoxyphenyl)sulfonylamino]-N-pyridin-2-ylbenzenesulfonamide
CID 92674441
4-[(4-ethoxyphenyl)sulfonylamino]-N-(2-methoxyphenyl)benzenesulfonamide
CID 22202817
2-carboxy-4-[(4-ethoxyphenyl)sulfonylamino]phenolate
CID 54710151
N-(1,3-benzodioxol-5-yl)-4-ethoxybenzenesulfonamide
CID 975650
4-ethoxy-N-(4-methylsulfanylphenyl)benzenesulfonamide
CID 8860403

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide?
The IUPAC name of 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide (CID 7938656) is 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide.
What is the SMILES notation for 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide?
The canonical SMILES for 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide is CCOc1ccc(S(=O)(=O)Nc2ccc3ccccc3c2)cc1.
What is the InChIKey of 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide?
The InChIKey is VONIFXNYGOMTKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO3S/c1-2-22-17-9-11-18(12-10-17)23(20,21)19-16-8-7-14-5-3-4-6-15(14)13-16/h3-13,19H,2H2,1H3.
What are the key properties of 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide?
4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide has a molecular weight of 327.41 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide is sourced from PubChem (CID 7938656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).