N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide

C11H15N3O5S — CID 108508709

IUPACN-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide
SMILESCC(O)CNC(=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C11H15N3O5S/c1-7(15)6-13-10(16)11(17)14-8-2-4-9(5-3-8)20(12,18)19/h2-5,7,15H,6H2,1H3,(H,13,16)(H,14,17)(H2,12,18,19)
InChIKeyCPIBOKKSIJOTLP-UHFFFAOYSA-N
MW301.32 g/mol
LogP-1.23
Rot. Bonds4

About N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide

N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide (PubChem CID 108508709) has the molecular formula C11H15N3O5S and a molecular weight of 301.32 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide
PubChem CID108508709
Molecular FormulaC11H15N3O5S
Molecular Weight301.32 g/mol
Exact Mass301.07
IUPAC NameN-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide
SMILESCC(O)CNC(=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C11H15N3O5S/c1-7(15)6-13-10(16)11(17)14-8-2-4-9(5-3-8)20(12,18)19/h2-5,7,15H,6H2,1H3,(H,13,16)(H,14,17)(H2,12,18,19)
InChIKeyCPIBOKKSIJOTLP-UHFFFAOYSA-N
XLogP-1.23
TPSA138.59 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.32
LogP ≤ 5-1.23
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N'-(4-ethylphenyl)-N-[(2S)-2-hydroxypropyl]oxamide
CID 2291462
N-(2-hydroxyethyl)-N'-(4-sulfamoylphenyl)oxamide
CID 108508767
N'-(4-anilinophenyl)-N-(2-hydroxypropyl)oxamide
CID 108521320
N-[4-(diethylamino)phenyl]-N'-(4-sulfamoylphenyl)oxamide
CID 108508799
2-methyl-3-(methylamino)-N-(4-sulfamoylphenyl)propanamide
CID 79195981
N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide
CID 108508654
N-[(2R)-2-hydroxypropyl]-N'-[6-(trifluoromethyl)-3-pyridinyl]oxamide
CID 124652117
N-(2-methylpropyl)-2-(4-sulfamoylanilino)acetamide
CID 112688467
N-(3-formamidopropyl)-N'-(4-sulfamoylphenyl)oxamide
CID 108508777
N'-(2,6-dimethylphenyl)-N-(4-sulfamoylphenyl)oxamide
CID 108508841
(2R)-2-bromo-N-(4-sulfamoylphenyl)butanamide
CID 94883529
2-methylpropyl N-(4-sulfamoylphenyl)carbamate
CID 18934427

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide?
The IUPAC name of N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide (CID 108508709) is N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide?
The canonical SMILES for N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide is CC(O)CNC(=O)C(=O)Nc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide?
The InChIKey is CPIBOKKSIJOTLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O5S/c1-7(15)6-13-10(16)11(17)14-8-2-4-9(5-3-8)20(12,18)19/h2-5,7,15H,6H2,1H3,(H,13,16)(H,14,17)(H2,12,18,19).
What are the key properties of N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide?
N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide has a molecular weight of 301.32 g/mol, XLogP of -1.23, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-N'-(4-sulfamoylphenyl)oxamide is sourced from PubChem (CID 108508709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).