N-(4-methoxyphenyl)-1-phenylmethanesulfonamide

C14H15NO3S — CID 669281

IUPACN-(4-methoxyphenyl)-1-phenylmethanesulfonamide
SMILESCOc1ccc(NS(=O)(=O)Cc2ccccc2)cc1
InChIInChI=1S/C14H15NO3S/c1-18-14-9-7-13(8-10-14)15-19(16,17)11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3
InChIKeyYRXFZWXDQVXXEX-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.64
Rot. Bonds5

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

N-(4-methoxyphenyl)-1-phenylmethanesulfonamide (PubChem CID 669281) has the molecular formula C14H15NO3S and a molecular weight of 277.35 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1-phenylmethanesulfonamide
PubChem CID669281
Molecular FormulaC14H15NO3S
Molecular Weight277.35 g/mol
Exact Mass277.08
IUPAC NameN-(4-methoxyphenyl)-1-phenylmethanesulfonamide
SMILESCOc1ccc(NS(=O)(=O)Cc2ccccc2)cc1
InChIInChI=1S/C14H15NO3S/c1-18-14-9-7-13(8-10-14)15-19(16,17)11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3
InChIKeyYRXFZWXDQVXXEX-UHFFFAOYSA-N
XLogP2.64
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-1-phenylmethanesulfonamide?
The IUPAC name of N-(4-methoxyphenyl)-1-phenylmethanesulfonamide (CID 669281) is N-(4-methoxyphenyl)-1-phenylmethanesulfonamide.
What is the SMILES notation for N-(4-methoxyphenyl)-1-phenylmethanesulfonamide?
The canonical SMILES for N-(4-methoxyphenyl)-1-phenylmethanesulfonamide is COc1ccc(NS(=O)(=O)Cc2ccccc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1-phenylmethanesulfonamide?
The InChIKey is YRXFZWXDQVXXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3S/c1-18-14-9-7-13(8-10-14)15-19(16,17)11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3.
What are the key properties of N-(4-methoxyphenyl)-1-phenylmethanesulfonamide?
N-(4-methoxyphenyl)-1-phenylmethanesulfonamide has a molecular weight of 277.35 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1-phenylmethanesulfonamide is sourced from PubChem (CID 669281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).