3-[4-(ethylsulfamoyl)phenyl]propanamide

C11H16N2O3S — CID 2981741

IUPAC3-[4-(ethylsulfamoyl)phenyl]propanamide
SMILESCCNS(=O)(=O)c1ccc(CCC(N)=O)cc1
InChIInChI=1S/C11H16N2O3S/c1-2-13-17(15,16)10-6-3-9(4-7-10)5-8-11(12)14/h3-4,6-7,13H,2,5,8H2,1H3,(H2,12,14)
InChIKeySWMRQXYZPJDRRY-UHFFFAOYSA-N
MW256.33 g/mol
LogP0.40
Rot. Bonds6

About 3-[4-(ethylsulfamoyl)phenyl]propanamide

3-[4-(ethylsulfamoyl)phenyl]propanamide (PubChem CID 2981741) has the molecular formula C11H16N2O3S and a molecular weight of 256.33 g/mol. Its IUPAC name is 3-[4-(ethylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound Name3-[4-(ethylsulfamoyl)phenyl]propanamide
PubChem CID2981741
Molecular FormulaC11H16N2O3S
Molecular Weight256.33 g/mol
Exact Mass256.09
IUPAC Name3-[4-(ethylsulfamoyl)phenyl]propanamide
SMILESCCNS(=O)(=O)c1ccc(CCC(N)=O)cc1
InChIInChI=1S/C11H16N2O3S/c1-2-13-17(15,16)10-6-3-9(4-7-10)5-8-11(12)14/h3-4,6-7,13H,2,5,8H2,1H3,(H2,12,14)
InChIKeySWMRQXYZPJDRRY-UHFFFAOYSA-N
XLogP0.40
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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

4-(2-Aminoethyl)benzenesulfonamide
CID 169682
N-[2-[4-(aminosulphonyl)phenyl]ethyl]acetamide
CID 745994
N-Butyl-p-toluenesulfonamide
CID 61285
Hexanoic acid, 6-[[(4-methylphenyl)sulfonyl]amino]-
CID 95822
2-Propyl-pentanoic acid 4-sulfamoyl-benzylamide
CID 10946908
(2-Cyclohex-1-enylethyl)[(4-methylphenyl)sulfonyl]amine
CID 737669
3-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
CID 670778
N-(4-methylphenyl)sulfonylcyclohexanecarboxamide
CID 4879102
Sulfonamide deriv., 7c
CID 3433937
N-cyclohexyl-3-{4-[(isobutylamino)sulfonyl]phenyl}propanamide
CID 1210859
3-{4-[(isobutylamino)sulfonyl]phenyl}-N-(2-phenylethyl)propanamide
CID 1289346
4-ethyl-N-(2-oxoazepan-3-yl)benzenesulfonamide
CID 2738684

Frequently Asked Questions

What is the IUPAC name of 3-[4-(ethylsulfamoyl)phenyl]propanamide?
The IUPAC name of 3-[4-(ethylsulfamoyl)phenyl]propanamide (CID 2981741) is 3-[4-(ethylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for 3-[4-(ethylsulfamoyl)phenyl]propanamide?
The canonical SMILES for 3-[4-(ethylsulfamoyl)phenyl]propanamide is CCNS(=O)(=O)c1ccc(CCC(N)=O)cc1.
What is the InChIKey of 3-[4-(ethylsulfamoyl)phenyl]propanamide?
The InChIKey is SWMRQXYZPJDRRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3S/c1-2-13-17(15,16)10-6-3-9(4-7-10)5-8-11(12)14/h3-4,6-7,13H,2,5,8H2,1H3,(H2,12,14).
What are the key properties of 3-[4-(ethylsulfamoyl)phenyl]propanamide?
3-[4-(ethylsulfamoyl)phenyl]propanamide has a molecular weight of 256.33 g/mol, XLogP of 0.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(ethylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 2981741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).