N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide

C15H22N2O5S — CID 6458754

IUPACN-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide
SMILESCCOc1ccc(S(=O)(=O)NCC2CCCO2)cc1NC(C)=O
InChIInChI=1S/C15H22N2O5S/c1-3-21-15-7-6-13(9-14(15)17-11(2)18)23(19,20)16-10-12-5-4-8-22-12/h6-7,9,12,16H,3-5,8,10H2,1-2H3,(H,17,18)
InChIKeyHPIPXOYMVDKHIX-UHFFFAOYSA-N
MW342.42 g/mol
LogP1.50
Rot. Bonds7

About N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide

N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide (PubChem CID 6458754) has the molecular formula C15H22N2O5S and a molecular weight of 342.42 g/mol. Its IUPAC name is N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide
PubChem CID6458754
Molecular FormulaC15H22N2O5S
Molecular Weight342.42 g/mol
Exact Mass342.12
IUPAC NameN-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide
SMILESCCOc1ccc(S(=O)(=O)NCC2CCCO2)cc1NC(C)=O
InChIInChI=1S/C15H22N2O5S/c1-3-21-15-7-6-13(9-14(15)17-11(2)18)23(19,20)16-10-12-5-4-8-22-12/h6-7,9,12,16H,3-5,8,10H2,1-2H3,(H,17,18)
InChIKeyHPIPXOYMVDKHIX-UHFFFAOYSA-N
XLogP1.50
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-methoxy-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]phenyl]acetamide
CID 42066685
3,4,5-triethoxy-N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 3930366
6-ethoxy-N-[[(2R)-oxolan-2-yl]methyl]naphthalene-2-sulfonamide
CID 870159
N-[[(2S)-oxolan-2-yl]methyl]-3,4-dipropoxybenzenesulfonamide
CID 95864984
2-[2-methyl-4-(oxolan-2-ylmethylsulfamoyl)phenoxy]acetamide
CID 102551738
N-(4-ethoxy-3-methoxyphenyl)-3-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 30545290
4-butoxy-3-methyl-N-[[(2S)-oxolan-2-yl]methyl]benzenesulfonamide
CID 40793365
4-acetyl-N-(oxolan-2-ylmethyl)benzenesulfonamide
CID 3401907
N-[2,5-diethoxy-4-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]phenyl]acetamide
CID 1172906
4-methoxy-N-(oxolan-2-ylmethyl)-3-propan-2-ylbenzenesulfonamide
CID 6471718
2-[2-chloro-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]phenoxy]acetic acid
CID 146130981
3-iodo-4-methoxy-N-[[(2R)-oxolan-2-yl]methyl]benzenesulfonamide
CID 1248695

Frequently Asked Questions

What is the IUPAC name of N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide?
The IUPAC name of N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide (CID 6458754) is N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide?
The canonical SMILES for N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide is CCOc1ccc(S(=O)(=O)NCC2CCCO2)cc1NC(C)=O.
What is the InChIKey of N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide?
The InChIKey is HPIPXOYMVDKHIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O5S/c1-3-21-15-7-6-13(9-14(15)17-11(2)18)23(19,20)16-10-12-5-4-8-22-12/h6-7,9,12,16H,3-5,8,10H2,1-2H3,(H,17,18).
What are the key properties of N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide?
N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide has a molecular weight of 342.42 g/mol, XLogP of 1.50, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-ethoxy-5-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 6458754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).