N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide

C16H24N2O5S — CID 2955531

IUPACN-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide
SMILESCCCNS(=O)(=O)c1ccc(OCC(=O)NCC2CCCO2)cc1
InChIInChI=1S/C16H24N2O5S/c1-2-9-18-24(20,21)15-7-5-13(6-8-15)23-12-16(19)17-11-14-4-3-10-22-14/h5-8,14,18H,2-4,9-12H2,1H3,(H,17,19)
InChIKeyTZGWKAQTTZVHGL-UHFFFAOYSA-N
MW356.44 g/mol
LogP1.05
Rot. Bonds9

About N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide

N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide (PubChem CID 2955531) has the molecular formula C16H24N2O5S and a molecular weight of 356.44 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide
PubChem CID2955531
Molecular FormulaC16H24N2O5S
Molecular Weight356.44 g/mol
Exact Mass356.14
IUPAC NameN-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide
SMILESCCCNS(=O)(=O)c1ccc(OCC(=O)NCC2CCCO2)cc1
InChIInChI=1S/C16H24N2O5S/c1-2-9-18-24(20,21)15-7-5-13(6-8-15)23-12-16(19)17-11-14-4-3-10-22-14/h5-8,14,18H,2-4,9-12H2,1H3,(H,17,19)
InChIKeyTZGWKAQTTZVHGL-UHFFFAOYSA-N
XLogP1.05
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.44
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 1088506
2-[4-[[(2S)-butan-2-yl]sulfamoyl]phenoxy]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 1088507
2-[4-(dimethylsulfamoyl)phenoxy]-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 27261642
ethyl 2-[4-(oxolan-2-ylmethylsulfamoyl)phenoxy]acetate
CID 2943598
[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 4-(ethylsulfamoyl)benzoate
CID 7828186
2-(4-methylphenoxy)-N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide
CID 17105820
N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 18168439
[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl] 2-[(3,4-dimethylphenyl)sulfonylamino]acetate
CID 7570270
[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 2-[(3,4-dimethylphenyl)sulfonylamino]acetate
CID 7570267
4-[(4-ethoxyphenyl)sulfonylamino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 26871354
N-(3-morpholin-4-ylpropyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide
CID 45372530
2-[(4-ethoxyphenyl)sulfonylamino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 1327378

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide (CID 2955531) is N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide is CCCNS(=O)(=O)c1ccc(OCC(=O)NCC2CCCO2)cc1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide?
The InChIKey is TZGWKAQTTZVHGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O5S/c1-2-9-18-24(20,21)15-7-5-13(6-8-15)23-12-16(19)17-11-14-4-3-10-22-14/h5-8,14,18H,2-4,9-12H2,1H3,(H,17,19).
What are the key properties of N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide?
N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide has a molecular weight of 356.44 g/mol, XLogP of 1.05, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-2-[4-(propylsulfamoyl)phenoxy]acetamide is sourced from PubChem (CID 2955531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).