N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide

C13H20N2O3S — CID 112507167

IUPACN-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide
SMILESCCNS(=O)(=O)c1ccc(CCNC(=O)CC)cc1
InChIInChI=1S/C13H20N2O3S/c1-3-13(16)14-10-9-11-5-7-12(8-6-11)19(17,18)15-4-2/h5-8,15H,3-4,9-10H2,1-2H3,(H,14,16)
InChIKeyPBYZQJGIMMQCCJ-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.05
Rot. Bonds7

About N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide

N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide (PubChem CID 112507167) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide.

Molecular Properties

Compound NameN-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide
PubChem CID112507167
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC NameN-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide
SMILESCCNS(=O)(=O)c1ccc(CCNC(=O)CC)cc1
InChIInChI=1S/C13H20N2O3S/c1-3-13(16)14-10-9-11-5-7-12(8-6-11)19(17,18)15-4-2/h5-8,15H,3-4,9-10H2,1-2H3,(H,14,16)
InChIKeyPBYZQJGIMMQCCJ-UHFFFAOYSA-N
XLogP1.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-3-methylbutanamide
CID 112507172
3-[4-(ethylsulfamoyl)phenyl]-N-propylpropanamide
CID 2224602
N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(4-methylphenoxy)acetamide
CID 112507216
N-[2-[(4-ethylphenyl)sulfonylamino]ethyl]propanamide
CID 108574101
4-(ethylsulfamoyl)-N-(2-phenylethyl)benzamide
CID 51160983
N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]furan-2-carboxamide
CID 112507177
N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide
CID 110624165
4-(2-aminoethyl)-N-ethylbenzenesulfonamide
CID 16643231
2-cyclopropyl-N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-phenylacetamide
CID 110624148
N-[2-[(4-bromophenyl)sulfonylamino]ethyl]propanamide
CID 108574108
4-[2-(benzylsulfonylamino)ethyl]-N-ethylbenzenesulfonamide
CID 112507244
N-[2-(4-methylsulfanylphenyl)ethyl]propanamide
CID 110790560

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide?
The IUPAC name of N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide (CID 112507167) is N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide.
What is the SMILES notation for N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide?
The canonical SMILES for N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide is CCNS(=O)(=O)c1ccc(CCNC(=O)CC)cc1.
What is the InChIKey of N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide?
The InChIKey is PBYZQJGIMMQCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-3-13(16)14-10-9-11-5-7-12(8-6-11)19(17,18)15-4-2/h5-8,15H,3-4,9-10H2,1-2H3,(H,14,16).
What are the key properties of N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide?
N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide has a molecular weight of 284.38 g/mol, XLogP of 1.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]propanamide is sourced from PubChem (CID 112507167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).