N-methoxy-N-phenylbenzenesulfonamide

C13H13NO3S — CID 10801496

IUPACN-methoxy-N-phenylbenzenesulfonamide
SMILESCON(c1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C13H13NO3S/c1-17-14(12-8-4-2-5-9-12)18(15,16)13-10-6-3-7-11-13/h2-11H,1H3
InChIKeyRUECDUWYCNUBEY-UHFFFAOYSA-N
MW263.32 g/mol
LogP2.44
Rot. Bonds4

About N-methoxy-N-phenylbenzenesulfonamide

N-methoxy-N-phenylbenzenesulfonamide (PubChem CID 10801496) has the molecular formula C13H13NO3S and a molecular weight of 263.32 g/mol. Its IUPAC name is N-methoxy-N-phenylbenzenesulfonamide.

Molecular Properties

Compound NameN-methoxy-N-phenylbenzenesulfonamide
PubChem CID10801496
Molecular FormulaC13H13NO3S
Molecular Weight263.32 g/mol
Exact Mass263.06
IUPAC NameN-methoxy-N-phenylbenzenesulfonamide
SMILESCON(c1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C13H13NO3S/c1-17-14(12-8-4-2-5-9-12)18(15,16)13-10-6-3-7-11-13/h2-11H,1H3
InChIKeyRUECDUWYCNUBEY-UHFFFAOYSA-N
XLogP2.44
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methoxy-N-phenyl-4-(trifluoromethyl)benzenesulfonamide
CID 166448950
2-hydroxy-5-[methoxy(phenyl)sulfamoyl]benzoic acid
CID 57476934
N,N-diphenylbenzenesulfonamide;N-methyl-N-phenylbenzenesulfonamide
CID 158565705
N-methoxy-N-phenylprop-2-ene-1-sulfonamide
CID 87802468
N-methoxy-N-(trifluoromethyl)benzenesulfonamide
CID 13351208
N-tert-butyl-N-(methoxymethyl)benzenesulfonamide
CID 69186977
N-[3-[methoxy(phenyl)sulfamoyl]-5,6,7,8-tetrahydronaphthalen-1-yl]benzamide
CID 90924177
N-(bromomethyl)-N-methylbenzenesulfonamide
CID 66916911
N,N-bis[4-(2-methylpropyl)phenyl]benzenesulfonamide
CID 141472327
N-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]benzenesulfonamide
CID 123917247
benzene;benzenesulfonylbenzene;ethane;methoxymethane
CID 158977372
N-[(2S)-3-methoxy-2-methyl-2-phenylpropyl]-N-methylbenzenesulfonamide
CID 90322547

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-phenylbenzenesulfonamide?
The IUPAC name of N-methoxy-N-phenylbenzenesulfonamide (CID 10801496) is N-methoxy-N-phenylbenzenesulfonamide.
What is the SMILES notation for N-methoxy-N-phenylbenzenesulfonamide?
The canonical SMILES for N-methoxy-N-phenylbenzenesulfonamide is CON(c1ccccc1)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-methoxy-N-phenylbenzenesulfonamide?
The InChIKey is RUECDUWYCNUBEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO3S/c1-17-14(12-8-4-2-5-9-12)18(15,16)13-10-6-3-7-11-13/h2-11H,1H3.
What are the key properties of N-methoxy-N-phenylbenzenesulfonamide?
N-methoxy-N-phenylbenzenesulfonamide has a molecular weight of 263.32 g/mol, XLogP of 2.44, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-phenylbenzenesulfonamide is sourced from PubChem (CID 10801496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).