2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide

C19H24N2O5S — CID 126201924

IUPAC2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide
SMILESCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)Nc2cccc(OC)c2)cc1
InChIInChI=1S/C19H24N2O5S/c1-4-14(2)21-27(23,24)18-10-8-16(9-11-18)26-13-19(22)20-15-6-5-7-17(12-15)25-3/h5-12,14,21H,4,13H2,1-3H3,(H,20,22)/t14-/m1/s1
InChIKeyKEUBUUHGLDYUGB-CQSZACIVSA-N
MW392.48 g/mol
LogP2.79
Rot. Bonds9

About 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide

2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide (PubChem CID 126201924) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide
PubChem CID126201924
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC Name2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide
SMILESCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)Nc2cccc(OC)c2)cc1
InChIInChI=1S/C19H24N2O5S/c1-4-14(2)21-27(23,24)18-10-8-16(9-11-18)26-13-19(22)20-15-6-5-7-17(12-15)25-3/h5-12,14,21H,4,13H2,1-3H3,(H,20,22)/t14-/m1/s1
InChIKeyKEUBUUHGLDYUGB-CQSZACIVSA-N
XLogP2.79
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide (CID 126201924) is 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide is CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)Nc2cccc(OC)c2)cc1.
What is the InChIKey of 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide?
The InChIKey is KEUBUUHGLDYUGB-CQSZACIVSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-4-14(2)21-27(23,24)18-10-8-16(9-11-18)26-13-19(22)20-15-6-5-7-17(12-15)25-3/h5-12,14,21H,4,13H2,1-3H3,(H,20,22)/t14-/m1/s1.
What are the key properties of 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide?
2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide has a molecular weight of 392.48 g/mol, XLogP of 2.79, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 126201924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).