N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide

C12H18N2O4S — CID 43082414

IUPACN-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide
SMILESCOc1ccc(NC(=O)C(C)(C)C)cc1S(N)(=O)=O
InChIInChI=1S/C12H18N2O4S/c1-12(2,3)11(15)14-8-5-6-9(18-4)10(7-8)19(13,16)17/h5-7H,1-4H3,(H,14,15)(H2,13,16,17)
InChIKeyHLBYTWSUAVXJRY-UHFFFAOYSA-N
MW286.35 g/mol
LogP1.33
Rot. Bonds3

About N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide

N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide (PubChem CID 43082414) has the molecular formula C12H18N2O4S and a molecular weight of 286.35 g/mol. Its IUPAC name is N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide
PubChem CID43082414
Molecular FormulaC12H18N2O4S
Molecular Weight286.35 g/mol
Exact Mass286.10
IUPAC NameN-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide
SMILESCOc1ccc(NC(=O)C(C)(C)C)cc1S(N)(=O)=O
InChIInChI=1S/C12H18N2O4S/c1-12(2,3)11(15)14-8-5-6-9(18-4)10(7-8)19(13,16)17/h5-7H,1-4H3,(H,14,15)(H2,13,16,17)
InChIKeyHLBYTWSUAVXJRY-UHFFFAOYSA-N
XLogP1.33
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dichloro-N-(4-methoxy-3-sulfamoylphenyl)benzamide
CID 26929610
N-(4-methoxy-3-sulfamoylphenyl)-1-methylpyrrole-2-carboxamide
CID 60631248
N-[3-[(2-bromo-5-methylphenyl)sulfamoyl]-4-methoxyphenyl]-2,2-dimethylpropanamide
CID 25335535
4-methoxy-N-(4-methoxy-3-sulfamoylphenyl)butanamide
CID 47245842
N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-2,2-dimethylpropanamide
CID 4578456
N-(3-methoxy-4-sulfamoylphenyl)-2,2-dimethylbutanamide
CID 62677873
1-cyclobutyl-3-(4-methoxy-3-sulfamoylphenyl)urea
CID 116658847
5-acetyl-N-(4-methoxy-3-sulfamoylphenyl)thiophene-2-carboxamide
CID 9088476
N-(4-methoxy-3-sulfamoylphenyl)pyridazine-4-carboxamide
CID 115742535
2-(2-tert-butylphenoxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide
CID 26782054
N-(4-methoxy-3-sulfamoylphenyl)-2H-triazole-4-carboxamide
CID 112733236
N-(4-methoxy-3-sulfamoylphenyl)thiadiazole-4-carboxamide
CID 61068916

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide (CID 43082414) is N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide is COc1ccc(NC(=O)C(C)(C)C)cc1S(N)(=O)=O.
What is the InChIKey of N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide?
The InChIKey is HLBYTWSUAVXJRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4S/c1-12(2,3)11(15)14-8-5-6-9(18-4)10(7-8)19(13,16)17/h5-7H,1-4H3,(H,14,15)(H2,13,16,17).
What are the key properties of N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide?
N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide has a molecular weight of 286.35 g/mol, XLogP of 1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 43082414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).