N,3-dimethylnaphthalene-2-sulfonamide

C12H13NO2S — CID 68839687

IUPACN,3-dimethylnaphthalene-2-sulfonamide
SMILESCNS(=O)(=O)c1cc2ccccc2cc1C
InChIInChI=1S/C12H13NO2S/c1-9-7-10-5-3-4-6-11(10)8-12(9)16(14,15)13-2/h3-8,13H,1-2H3
InChIKeyMBQWGFLWCICCQM-UHFFFAOYSA-N
MW235.31 g/mol
LogP2.06
Rot. Bonds2

About N,3-dimethylnaphthalene-2-sulfonamide

N,3-dimethylnaphthalene-2-sulfonamide (PubChem CID 68839687) has the molecular formula C12H13NO2S and a molecular weight of 235.31 g/mol. Its IUPAC name is N,3-dimethylnaphthalene-2-sulfonamide.

Molecular Properties

Compound NameN,3-dimethylnaphthalene-2-sulfonamide
PubChem CID68839687
Molecular FormulaC12H13NO2S
Molecular Weight235.31 g/mol
Exact Mass235.07
IUPAC NameN,3-dimethylnaphthalene-2-sulfonamide
SMILESCNS(=O)(=O)c1cc2ccccc2cc1C
InChIInChI=1S/C12H13NO2S/c1-9-7-10-5-3-4-6-11(10)8-12(9)16(14,15)13-2/h3-8,13H,1-2H3
InChIKeyMBQWGFLWCICCQM-UHFFFAOYSA-N
XLogP2.06
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethylnaphthalene-2-sulfonamide?
The IUPAC name of N,3-dimethylnaphthalene-2-sulfonamide (CID 68839687) is N,3-dimethylnaphthalene-2-sulfonamide.
What is the SMILES notation for N,3-dimethylnaphthalene-2-sulfonamide?
The canonical SMILES for N,3-dimethylnaphthalene-2-sulfonamide is CNS(=O)(=O)c1cc2ccccc2cc1C.
What is the InChIKey of N,3-dimethylnaphthalene-2-sulfonamide?
The InChIKey is MBQWGFLWCICCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2S/c1-9-7-10-5-3-4-6-11(10)8-12(9)16(14,15)13-2/h3-8,13H,1-2H3.
What are the key properties of N,3-dimethylnaphthalene-2-sulfonamide?
N,3-dimethylnaphthalene-2-sulfonamide has a molecular weight of 235.31 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethylnaphthalene-2-sulfonamide is sourced from PubChem (CID 68839687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).