N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide

C19H33N3O3S — CID 55393884

IUPACN-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide
SMILESCCN(CC)CCNC(=O)CCc1ccc(S(=O)(=O)N(CC)CC)cc1
InChIInChI=1S/C19H33N3O3S/c1-5-21(6-2)16-15-20-19(23)14-11-17-9-12-18(13-10-17)26(24,25)22(7-3)8-4/h9-10,12-13H,5-8,11,14-16H2,1-4H3,(H,20,23)
InChIKeyPIOUKWYLPCTYDX-UHFFFAOYSA-N
MW383.56 g/mol
LogP2.11
Rot. Bonds12

About N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide

N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide (PubChem CID 55393884) has the molecular formula C19H33N3O3S and a molecular weight of 383.56 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide
PubChem CID55393884
Molecular FormulaC19H33N3O3S
Molecular Weight383.56 g/mol
Exact Mass383.22
IUPAC NameN-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide
SMILESCCN(CC)CCNC(=O)CCc1ccc(S(=O)(=O)N(CC)CC)cc1
InChIInChI=1S/C19H33N3O3S/c1-5-21(6-2)16-15-20-19(23)14-11-17-9-12-18(13-10-17)26(24,25)22(7-3)8-4/h9-10,12-13H,5-8,11,14-16H2,1-4H3,(H,20,23)
InChIKeyPIOUKWYLPCTYDX-UHFFFAOYSA-N
XLogP2.11
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.56
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(diethylsulfamoyl)phenyl]-N-(3-hydroxypropyl)propanamide
CID 78821548
3-[4-(diethylsulfamoyl)phenyl]-N-[2-(dimethylamino)-2-oxoethyl]propanamide
CID 31337257
N-[[2-(diethylaminomethyl)phenyl]methyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide
CID 31640298
N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-(4-fluorophenyl)propanamide
CID 31747284
3-[4-(diethylsulfamoyl)phenyl]-N-[2-(methylamino)propyl]propanamide
CID 120828761
3-[4-(diethylsulfamoyl)phenyl]-N-[(4-methylsulfanylphenyl)methyl]propanamide
CID 60574292
3-[4-(diethylsulfamoyl)phenyl]-N-[[4-(ethoxymethyl)phenyl]methyl]propanamide
CID 37358087
3-[4-(diethylsulfamoyl)phenyl]-N-[(2R)-2-(ethylamino)propyl]propanamide;hydrochloride
CID 120654006
3-[4-(diethylsulfamoyl)phenyl]-N-(2-methylbutan-2-yl)propanamide
CID 51211052
(2S)-2-[3-[4-(diethylsulfamoyl)phenyl]propanoylamino]-N-ethylpropanamide
CID 33273657
3-[4-(diethylsulfamoyl)phenyl]-N-[(3-methylphenyl)methyl]propanamide
CID 33281109
N-[(2-chlorophenyl)methyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide
CID 26244985

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide (CID 55393884) is N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide is CCN(CC)CCNC(=O)CCc1ccc(S(=O)(=O)N(CC)CC)cc1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide?
The InChIKey is PIOUKWYLPCTYDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O3S/c1-5-21(6-2)16-15-20-19(23)14-11-17-9-12-18(13-10-17)26(24,25)22(7-3)8-4/h9-10,12-13H,5-8,11,14-16H2,1-4H3,(H,20,23).
What are the key properties of N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide?
N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide has a molecular weight of 383.56 g/mol, XLogP of 2.11, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-3-[4-(diethylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 55393884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).