3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide

C16H18N2O5S — CID 24640601

IUPAC3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide
SMILESCOc1ccccc1OCCC(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C16H18N2O5S/c1-22-14-4-2-3-5-15(14)23-11-10-16(19)18-12-6-8-13(9-7-12)24(17,20)21/h2-9H,10-11H2,1H3,(H,18,19)(H2,17,20,21)
InChIKeyBHNVSGUVPUFRKX-UHFFFAOYSA-N
MW350.40 g/mol
LogP1.75
Rot. Bonds7

About 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide

3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide (PubChem CID 24640601) has the molecular formula C16H18N2O5S and a molecular weight of 350.40 g/mol. Its IUPAC name is 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide.

Molecular Properties

Compound Name3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide
PubChem CID24640601
Molecular FormulaC16H18N2O5S
Molecular Weight350.40 g/mol
Exact Mass350.09
IUPAC Name3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide
SMILESCOc1ccccc1OCCC(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C16H18N2O5S/c1-22-14-4-2-3-5-15(14)23-11-10-16(19)18-12-6-8-13(9-7-12)24(17,20)21/h2-9H,10-11H2,1H3,(H,18,19)(H2,17,20,21)
InChIKeyBHNVSGUVPUFRKX-UHFFFAOYSA-N
XLogP1.75
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-anilinophenyl)-3-(2-methoxyphenoxy)propanamide
CID 60520385
2-methoxy-N-[3-oxo-3-(4-sulfamoylanilino)propyl]benzamide
CID 4843806
3-[(2,3-dimethoxyphenyl)methyl-methylamino]-N-(4-sulfamoylphenyl)propanamide
CID 24589039
methyl 4-oxo-4-(4-sulfamoylanilino)butanoate
CID 721949
3-amino-N-(4-sulfamoylphenyl)propanamide
CID 10776616
2,6-dimethoxy-N-(4-sulfamoylphenyl)benzamide
CID 954656
N-(4-aminophenyl)-3-(2-ethoxyphenoxy)propanamide
CID 43825399
N-[4-(2-methoxyphenoxy)phenyl]-3-phenoxypropanamide
CID 27901730
ethyl 4-[4-(2-methoxyphenoxy)butanoylamino]benzoate
CID 19180961
2-[4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl]-N-(4-sulfamoylphenyl)acetamide
CID 20970585
3-(2,2-difluoroethoxy)-N-(4-sulfamoylphenyl)propanamide
CID 103208726
3-(2-methoxyphenoxy)-N-[4-(4-methylpiperidin-1-yl)phenyl]propanamide
CID 60600910

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide?
The IUPAC name of 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide (CID 24640601) is 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide.
What is the SMILES notation for 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide?
The canonical SMILES for 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide is COc1ccccc1OCCC(=O)Nc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide?
The InChIKey is BHNVSGUVPUFRKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O5S/c1-22-14-4-2-3-5-15(14)23-11-10-16(19)18-12-6-8-13(9-7-12)24(17,20)21/h2-9H,10-11H2,1H3,(H,18,19)(H2,17,20,21).
What are the key properties of 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide?
3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide has a molecular weight of 350.40 g/mol, XLogP of 1.75, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenoxy)-N-(4-sulfamoylphenyl)propanamide is sourced from PubChem (CID 24640601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).