N-ethyl-3-(4-sulfamoylphenyl)propanamide

C11H16N2O3S — CID 47109333

IUPACN-ethyl-3-(4-sulfamoylphenyl)propanamide
SMILESCCNC(=O)CCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C11H16N2O3S/c1-2-13-11(14)8-5-9-3-6-10(7-4-9)17(12,15)16/h3-4,6-7H,2,5,8H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyCHJXTVMACVAPRK-UHFFFAOYSA-N
MW256.33 g/mol
LogP0.40
Rot. Bonds5

About N-ethyl-3-(4-sulfamoylphenyl)propanamide

N-ethyl-3-(4-sulfamoylphenyl)propanamide (PubChem CID 47109333) has the molecular formula C11H16N2O3S and a molecular weight of 256.33 g/mol. Its IUPAC name is N-ethyl-3-(4-sulfamoylphenyl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(4-sulfamoylphenyl)propanamide
PubChem CID47109333
Molecular FormulaC11H16N2O3S
Molecular Weight256.33 g/mol
Exact Mass256.09
IUPAC NameN-ethyl-3-(4-sulfamoylphenyl)propanamide
SMILESCCNC(=O)CCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C11H16N2O3S/c1-2-13-11(14)8-5-9-3-6-10(7-4-9)17(12,15)16/h3-4,6-7H,2,5,8H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyCHJXTVMACVAPRK-UHFFFAOYSA-N
XLogP0.40
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-propylphenyl)-3-(4-sulfamoylphenyl)propanamide
CID 24571120
N-(3-methylbutyl)-3-(4-sulfamoylphenyl)propanamide
CID 60651835
N-ethyl-3-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 5211556
N-[(2-methylcyclopropyl)methyl]-3-(4-sulfamoylphenyl)propanamide
CID 47189594
3-(3,5-dimethylphenyl)-N-[(4-sulfamoylphenyl)methyl]propanamide
CID 50971111
N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide
CID 115591226
N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-3-(4-sulfamoylphenyl)propanamide
CID 33426034
3-amino-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
CID 10707262
4-methyl-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide
CID 35156747
1-ethyl-3-[(4-sulfamoylphenyl)methyl]urea
CID 24685233
1-ethyl-3-[2-(4-sulfamoylphenyl)ethyl]thiourea
CID 748226
N-[(4-sulfamoylphenyl)methyl]pentanamide
CID 4162938

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(4-sulfamoylphenyl)propanamide?
The IUPAC name of N-ethyl-3-(4-sulfamoylphenyl)propanamide (CID 47109333) is N-ethyl-3-(4-sulfamoylphenyl)propanamide.
What is the SMILES notation for N-ethyl-3-(4-sulfamoylphenyl)propanamide?
The canonical SMILES for N-ethyl-3-(4-sulfamoylphenyl)propanamide is CCNC(=O)CCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N-ethyl-3-(4-sulfamoylphenyl)propanamide?
The InChIKey is CHJXTVMACVAPRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3S/c1-2-13-11(14)8-5-9-3-6-10(7-4-9)17(12,15)16/h3-4,6-7H,2,5,8H2,1H3,(H,13,14)(H2,12,15,16).
What are the key properties of N-ethyl-3-(4-sulfamoylphenyl)propanamide?
N-ethyl-3-(4-sulfamoylphenyl)propanamide has a molecular weight of 256.33 g/mol, XLogP of 0.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(4-sulfamoylphenyl)propanamide is sourced from PubChem (CID 47109333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).