N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide

C15H16N2O5S — CID 86174746

IUPACN-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NS(C)(=O)=O)c(Oc2ccc(O)cc2)c1
InChIInChI=1S/C15H16N2O5S/c1-10(18)16-11-3-8-14(17-23(2,20)21)15(9-11)22-13-6-4-12(19)5-7-13/h3-9,17,19H,1-2H3,(H,16,18)
InChIKeyGBAQPWOBYJFEMK-UHFFFAOYSA-N
MW336.37 g/mol
LogP2.51
Rot. Bonds5

About N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide

N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide (PubChem CID 86174746) has the molecular formula C15H16N2O5S and a molecular weight of 336.37 g/mol. Its IUPAC name is N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide
PubChem CID86174746
Molecular FormulaC15H16N2O5S
Molecular Weight336.37 g/mol
Exact Mass336.08
IUPAC NameN-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NS(C)(=O)=O)c(Oc2ccc(O)cc2)c1
InChIInChI=1S/C15H16N2O5S/c1-10(18)16-11-3-8-14(17-23(2,20)21)15(9-11)22-13-6-4-12(19)5-7-13/h3-9,17,19H,1-2H3,(H,16,18)
InChIKeyGBAQPWOBYJFEMK-UHFFFAOYSA-N
XLogP2.51
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide?
The IUPAC name of N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide (CID 86174746) is N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide.
What is the SMILES notation for N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide?
The canonical SMILES for N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide is CC(=O)Nc1ccc(NS(C)(=O)=O)c(Oc2ccc(O)cc2)c1.
What is the InChIKey of N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide?
The InChIKey is GBAQPWOBYJFEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O5S/c1-10(18)16-11-3-8-14(17-23(2,20)21)15(9-11)22-13-6-4-12(19)5-7-13/h3-9,17,19H,1-2H3,(H,16,18).
What are the key properties of N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide?
N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide has a molecular weight of 336.37 g/mol, XLogP of 2.51, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-hydroxyphenoxy)-4-(methanesulfonamido)phenyl]acetamide is sourced from PubChem (CID 86174746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).