N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide

C13H21N3O3S — CID 43226335

IUPACN-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide
SMILESCCCNC(=O)CNC(C)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H21N3O3S/c1-3-8-15-13(17)9-16-10(2)11-4-6-12(7-5-11)20(14,18)19/h4-7,10,16H,3,8-9H2,1-2H3,(H,15,17)(H2,14,18,19)
InChIKeyQYVOSKJANJEHRR-UHFFFAOYSA-N
MW299.40 g/mol
LogP0.51
Rot. Bonds7

About N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide

N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide (PubChem CID 43226335) has the molecular formula C13H21N3O3S and a molecular weight of 299.40 g/mol. Its IUPAC name is N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide
PubChem CID43226335
Molecular FormulaC13H21N3O3S
Molecular Weight299.40 g/mol
Exact Mass299.13
IUPAC NameN-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide
SMILESCCCNC(=O)CNC(C)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H21N3O3S/c1-3-8-15-13(17)9-16-10(2)11-4-6-12(7-5-11)20(14,18)19/h4-7,10,16H,3,8-9H2,1-2H3,(H,15,17)(H2,14,18,19)
InChIKeyQYVOSKJANJEHRR-UHFFFAOYSA-N
XLogP0.51
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpropyl)-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide
CID 115571074
N-propan-2-yl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide
CID 43218255
N-tert-butyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide
CID 115356169
2-[1-[4-(2-methylpropyl)phenyl]ethylamino]-N-propylacetamide
CID 43400934
methyl 2-[1-(4-sulfamoylphenyl)ethylamino]acetate
CID 43228683
N-butyl-2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]acetamide
CID 81354492
4-[1-(3-aminopropylamino)ethyl]benzenesulfonamide
CID 60890115
2-(butan-2-ylamino)-N-[(4-sulfamoylphenyl)methyl]acetamide
CID 60652957
4-[1-[(2-hydroxy-2-methylpentyl)amino]ethyl]benzenesulfonamide
CID 103910771
4-[1-[2-(tert-butylamino)ethylamino]ethyl]benzenesulfonamide
CID 107444925
4-[1-[2-(dimethylamino)ethylamino]ethyl]benzenesulfonamide
CID 43754787
4-[1-(2-methoxyethylamino)ethyl]benzenesulfonamide
CID 43426324

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide?
The IUPAC name of N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide (CID 43226335) is N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide.
What is the SMILES notation for N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide?
The canonical SMILES for N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide is CCCNC(=O)CNC(C)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide?
The InChIKey is QYVOSKJANJEHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3S/c1-3-8-15-13(17)9-16-10(2)11-4-6-12(7-5-11)20(14,18)19/h4-7,10,16H,3,8-9H2,1-2H3,(H,15,17)(H2,14,18,19).
What are the key properties of N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide?
N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide has a molecular weight of 299.40 g/mol, XLogP of 0.51, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide is sourced from PubChem (CID 43226335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).