N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide

C19H17NO3S — CID 8512912

IUPACN-(4-phenoxyphenyl)-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C19H17NO3S/c21-24(22,15-16-7-3-1-4-8-16)20-17-11-13-19(14-12-17)23-18-9-5-2-6-10-18/h1-14,20H,15H2
InChIKeyXUTBPNKVGOPLMU-UHFFFAOYSA-N
MW339.42 g/mol
LogP4.42
Rot. Bonds6

About N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide

N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide (PubChem CID 8512912) has the molecular formula C19H17NO3S and a molecular weight of 339.42 g/mol. Its IUPAC name is N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-(4-phenoxyphenyl)-1-phenylmethanesulfonamide
PubChem CID8512912
Molecular FormulaC19H17NO3S
Molecular Weight339.42 g/mol
Exact Mass339.09
IUPAC NameN-(4-phenoxyphenyl)-1-phenylmethanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C19H17NO3S/c21-24(22,15-16-7-3-1-4-8-16)20-17-11-13-19(14-12-17)23-18-9-5-2-6-10-18/h1-14,20H,15H2
InChIKeyXUTBPNKVGOPLMU-UHFFFAOYSA-N
XLogP4.42
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-aminoethoxy)phenyl]-1-phenylmethanesulfonamide
CID 43369627
N-(4-cyanophenyl)-1-phenylmethanesulfonamide
CID 798666
N-[4-[4-(ethylsulfonylamino)phenoxy]phenyl]ethanesulfonamide
CID 1292287
N-[4-(benzylsulfonylamino)phenyl]acetamide
CID 743927
methyl 4-(benzylsulfonylamino)benzoate
CID 743645
3-amino-2-oxo-N-(4-phenoxyphenyl)propane-1-sulfonamide
CID 139820857
1-(4-fluorophenyl)-N-(2-phenoxypyrimidin-5-yl)methanesulfonamide
CID 122302499
N-[4-[(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)oxy]phenyl]-1-phenylmethanesulfonamide
CID 154529127
N-[3-(4-anilinoanilino)phenyl]-1-phenylmethanesulfonamide
CID 67859373
2-(2-methoxyethoxy)-N-(4-phenoxyphenyl)ethanesulfonamide
CID 110425621
1-phenyl-N-(4-propan-2-ylsulfanylphenyl)methanesulfonamide
CID 110778693
N-[4-(1,3-dioxoisoindol-2-yl)phenyl]-1-phenylmethanesulfonamide
CID 110352351

Frequently Asked Questions

What is the IUPAC name of N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide?
The IUPAC name of N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide (CID 8512912) is N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide.
What is the SMILES notation for N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide?
The canonical SMILES for N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide is O=S(=O)(Cc1ccccc1)Nc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide?
The InChIKey is XUTBPNKVGOPLMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3S/c21-24(22,15-16-7-3-1-4-8-16)20-17-11-13-19(14-12-17)23-18-9-5-2-6-10-18/h1-14,20H,15H2.
What are the key properties of N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide?
N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide has a molecular weight of 339.42 g/mol, XLogP of 4.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenoxyphenyl)-1-phenylmethanesulfonamide is sourced from PubChem (CID 8512912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).