N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide

C12H18N2O4S — CID 670303

IUPACN-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide
SMILESCOC[C@H](C)NS(=O)(=O)c1ccc(NC(C)=O)cc1
InChIInChI=1S/C12H18N2O4S/c1-9(8-18-3)14-19(16,17)12-6-4-11(5-7-12)13-10(2)15/h4-7,9,14H,8H2,1-3H3,(H,13,15)/t9-/m0/s1
InChIKeyGYDSXWAKJDHRJJ-VIFPVBQESA-N
MW286.35 g/mol
LogP0.96
Rot. Bonds6

About N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide

N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide (PubChem CID 670303) has the molecular formula C12H18N2O4S and a molecular weight of 286.35 g/mol. Its IUPAC name is N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide
PubChem CID670303
Molecular FormulaC12H18N2O4S
Molecular Weight286.35 g/mol
Exact Mass286.10
IUPAC NameN-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide
SMILESCOC[C@H](C)NS(=O)(=O)c1ccc(NC(C)=O)cc1
InChIInChI=1S/C12H18N2O4S/c1-9(8-18-3)14-19(16,17)12-6-4-11(5-7-12)13-10(2)15/h4-7,9,14H,8H2,1-3H3,(H,13,15)/t9-/m0/s1
InChIKeyGYDSXWAKJDHRJJ-VIFPVBQESA-N
XLogP0.96
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-methylbutanamide
CID 51331716
N-[4-(butan-2-ylsulfamoyl)phenyl]acetamide
CID 3113473
N-[4-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]phenyl]acetamide
CID 39086802
4-(1-methoxypropan-2-ylsulfamoyl)-N-(4-sulfamoylphenyl)benzamide
CID 42909880
2,6-difluoro-N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]benzamide
CID 78778266
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3-phenylbutanamide
CID 43007936
N-[4-[[(2S)-2-[(4-acetamidophenyl)sulfonylamino]propyl]sulfamoyl]phenyl]acetamide
CID 2179183
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]pyridine-2-carboxamide
CID 4780813
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-4-(trifluoromethylsulfanyl)benzamide
CID 46616213
4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide
CID 9294142
4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzenesulfonamide
CID 884361
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-4-phenoxybutanamide
CID 43007962

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide (CID 670303) is N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide is COC[C@H](C)NS(=O)(=O)c1ccc(NC(C)=O)cc1.
What is the InChIKey of N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide?
The InChIKey is GYDSXWAKJDHRJJ-VIFPVBQESA-N. The full InChI is InChI=1S/C12H18N2O4S/c1-9(8-18-3)14-19(16,17)12-6-4-11(5-7-12)13-10(2)15/h4-7,9,14H,8H2,1-3H3,(H,13,15)/t9-/m0/s1.
What are the key properties of N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide?
N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide has a molecular weight of 286.35 g/mol, XLogP of 0.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 670303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).