N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide

C11H16N2O6S — CID 46829322

IUPACN-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(S(=O)(=O)N(CCO)CC(=O)NO)cc1
InChIInChI=1S/C11H16N2O6S/c1-19-9-2-4-10(5-3-9)20(17,18)13(6-7-14)8-11(15)12-16/h2-5,14,16H,6-8H2,1H3,(H,12,15)
InChIKeyIVGHGMHNUBCTDC-UHFFFAOYSA-N
MW304.32 g/mol
LogP-0.82
Rot. Bonds7

About N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide

N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide (PubChem CID 46829322) has the molecular formula C11H16N2O6S and a molecular weight of 304.32 g/mol. Its IUPAC name is N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide
PubChem CID46829322
Molecular FormulaC11H16N2O6S
Molecular Weight304.32 g/mol
Exact Mass304.07
IUPAC NameN-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(S(=O)(=O)N(CCO)CC(=O)NO)cc1
InChIInChI=1S/C11H16N2O6S/c1-19-9-2-4-10(5-3-9)20(17,18)13(6-7-14)8-11(15)12-16/h2-5,14,16H,6-8H2,1H3,(H,12,15)
InChIKeyIVGHGMHNUBCTDC-UHFFFAOYSA-N
XLogP-0.82
TPSA116.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 5-0.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide?
The IUPAC name of N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide (CID 46829322) is N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide is COc1ccc(S(=O)(=O)N(CCO)CC(=O)NO)cc1.
What is the InChIKey of N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide?
The InChIKey is IVGHGMHNUBCTDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O6S/c1-19-9-2-4-10(5-3-9)20(17,18)13(6-7-14)8-11(15)12-16/h2-5,14,16H,6-8H2,1H3,(H,12,15).
What are the key properties of N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide?
N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide has a molecular weight of 304.32 g/mol, XLogP of -0.82, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 46829322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).