N-methylbenzenesulfonamide;yttrium

C7H8NO2SY- — CID 59486347

IUPACN-methylbenzenesulfonamide;yttrium
SMILESCNS(=O)(=O)c1cc[c-]cc1.[Y]
InChIInChI=1S/C7H8NO2S.Y/c1-8-11(9,10)7-5-3-2-4-6-7;/h3-6,8H,1H3;/q-1;
InChIKeyXIEDHQLQLIGDGN-UHFFFAOYSA-N
MW259.12 g/mol
LogP0.39
Rot. Bonds2

About N-methylbenzenesulfonamide;yttrium

N-methylbenzenesulfonamide;yttrium (PubChem CID 59486347) has the molecular formula C7H8NO2SY- and a molecular weight of 259.12 g/mol. Its IUPAC name is N-methylbenzenesulfonamide;yttrium.

Molecular Properties

Compound NameN-methylbenzenesulfonamide;yttrium
PubChem CID59486347
Molecular FormulaC7H8NO2SY-
Molecular Weight259.12 g/mol
Exact Mass258.93
IUPAC NameN-methylbenzenesulfonamide;yttrium
SMILESCNS(=O)(=O)c1cc[c-]cc1.[Y]
InChIInChI=1S/C7H8NO2S.Y/c1-8-11(9,10)7-5-3-2-4-6-7;/h3-6,8H,1H3;/q-1;
InChIKeyXIEDHQLQLIGDGN-UHFFFAOYSA-N
XLogP0.39
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.12
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methylbenzenesulfonamide;yttrium?
The IUPAC name of N-methylbenzenesulfonamide;yttrium (CID 59486347) is N-methylbenzenesulfonamide;yttrium.
What is the SMILES notation for N-methylbenzenesulfonamide;yttrium?
The canonical SMILES for N-methylbenzenesulfonamide;yttrium is CNS(=O)(=O)c1cc[c-]cc1.[Y].
What is the InChIKey of N-methylbenzenesulfonamide;yttrium?
The InChIKey is XIEDHQLQLIGDGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8NO2S.Y/c1-8-11(9,10)7-5-3-2-4-6-7;/h3-6,8H,1H3;/q-1;.
What are the key properties of N-methylbenzenesulfonamide;yttrium?
N-methylbenzenesulfonamide;yttrium has a molecular weight of 259.12 g/mol, XLogP of 0.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylbenzenesulfonamide;yttrium is sourced from PubChem (CID 59486347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).