2-(naphthalen-1-ylmethyl)benzenesulfonamide

C17H15NO2S — CID 69182114

IUPAC2-(naphthalen-1-ylmethyl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccccc1Cc1cccc2ccccc12
InChIInChI=1S/C17H15NO2S/c18-21(19,20)17-11-4-2-7-15(17)12-14-9-5-8-13-6-1-3-10-16(13)14/h1-11H,12H2,(H2,18,19,20)
InChIKeyRVKMASYLTSXMIV-UHFFFAOYSA-N
MW297.38 g/mol
LogP3.08
Rot. Bonds3

About 2-(naphthalen-1-ylmethyl)benzenesulfonamide

2-(naphthalen-1-ylmethyl)benzenesulfonamide (PubChem CID 69182114) has the molecular formula C17H15NO2S and a molecular weight of 297.38 g/mol. Its IUPAC name is 2-(naphthalen-1-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-(naphthalen-1-ylmethyl)benzenesulfonamide
PubChem CID69182114
Molecular FormulaC17H15NO2S
Molecular Weight297.38 g/mol
Exact Mass297.08
IUPAC Name2-(naphthalen-1-ylmethyl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccccc1Cc1cccc2ccccc12
InChIInChI=1S/C17H15NO2S/c18-21(19,20)17-11-4-2-7-15(17)12-14-9-5-8-13-6-1-3-10-16(13)14/h1-11H,12H2,(H2,18,19,20)
InChIKeyRVKMASYLTSXMIV-UHFFFAOYSA-N
XLogP3.08
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

azane;naphthalene-1-sulfonamide
CID 174765300
CID 66760372
CID 66760372
2-benzylbenzenesulfonamide;methane
CID 175312349
2-(2H-tetrazol-5-ylmethyl)benzenesulfonamide
CID 67935246
1-methylnaphthalene-2-sulfonamide
CID 57353049
(2S)-1-naphthalen-1-ylpropane-2-sulfonamide
CID 125482966
2-(oxetan-3-ylmethyl)benzenesulfonamide
CID 142797710
2-(2-bromobutyl)benzenesulfonamide
CID 63203633
CID 57419547
CID 57419547
2-[2-(2-sulfamoylphenyl)acetyl]benzoic acid
CID 152904860
naphthalene-1-sulfonic acid
CID 158712346
1-methylsulfonylnaphthalene
CID 11206535

Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-1-ylmethyl)benzenesulfonamide?
The IUPAC name of 2-(naphthalen-1-ylmethyl)benzenesulfonamide (CID 69182114) is 2-(naphthalen-1-ylmethyl)benzenesulfonamide.
What is the SMILES notation for 2-(naphthalen-1-ylmethyl)benzenesulfonamide?
The canonical SMILES for 2-(naphthalen-1-ylmethyl)benzenesulfonamide is NS(=O)(=O)c1ccccc1Cc1cccc2ccccc12.
What is the InChIKey of 2-(naphthalen-1-ylmethyl)benzenesulfonamide?
The InChIKey is RVKMASYLTSXMIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2S/c18-21(19,20)17-11-4-2-7-15(17)12-14-9-5-8-13-6-1-3-10-16(13)14/h1-11H,12H2,(H2,18,19,20).
What are the key properties of 2-(naphthalen-1-ylmethyl)benzenesulfonamide?
2-(naphthalen-1-ylmethyl)benzenesulfonamide has a molecular weight of 297.38 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-1-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 69182114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).