1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole

C11H23N5O2S — CID 106018170

IUPAC1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole
SMILESCCNCCCN(C)S(=O)(=O)NCCn1ccnc1
InChIInChI=1S/C11H23N5O2S/c1-3-12-5-4-8-15(2)19(17,18)14-7-10-16-9-6-13-11-16/h6,9,11-12,14H,3-5,7-8,10H2,1-2H3
InChIKeyIXYKSBIATZNUMP-UHFFFAOYSA-N
MW289.40 g/mol
LogP-0.35
Rot. Bonds10

About 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole

1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole (PubChem CID 106018170) has the molecular formula C11H23N5O2S and a molecular weight of 289.40 g/mol. Its IUPAC name is 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole.

Molecular Properties

Compound Name1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole
PubChem CID106018170
Molecular FormulaC11H23N5O2S
Molecular Weight289.40 g/mol
Exact Mass289.16
IUPAC Name1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole
SMILESCCNCCCN(C)S(=O)(=O)NCCn1ccnc1
InChIInChI=1S/C11H23N5O2S/c1-3-12-5-4-8-15(2)19(17,18)14-7-10-16-9-6-13-11-16/h6,9,11-12,14H,3-5,7-8,10H2,1-2H3
InChIKeyIXYKSBIATZNUMP-UHFFFAOYSA-N
XLogP-0.35
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]propyl]imidazole
CID 106010320
1-[3-[[methyl(propan-2-yl)sulfamoyl]amino]propyl]imidazole
CID 56812922
1-[2-[[methyl-[3-(propylamino)propyl]sulfamoyl]amino]ethyl]triazole
CID 106077211
N-(3-imidazol-1-ylpropyl)ethanesulfonamide
CID 19685069
2-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]-1H-imidazole
CID 106085278
1-[[3-(ethylamino)propyl-methylsulfamoyl]amino]-4-methylpentane
CID 106017119
4-[[[3-(ethylamino)propyl-methylsulfamoyl]amino]methyl]-1,3,5-trimethylpyrazole
CID 106069841
3-(ethylamino)-N-(3-imidazol-1-ylpropyl)propanamide
CID 62833387
N'-(3-imidazol-1-ylpropyl)-N-propylethane-1,2-diamine
CID 53216159
2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]pyrimidine
CID 114141697
1-[2-[[methyl-[3-(methylamino)propyl]sulfamoyl]amino]ethyl]triazole
CID 106077188
N-(6-imidazol-1-ylhexyl)methanesulfonamide
CID 110441232

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole?
The IUPAC name of 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole (CID 106018170) is 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole.
What is the SMILES notation for 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole?
The canonical SMILES for 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole is CCNCCCN(C)S(=O)(=O)NCCn1ccnc1.
What is the InChIKey of 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole?
The InChIKey is IXYKSBIATZNUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N5O2S/c1-3-12-5-4-8-15(2)19(17,18)14-7-10-16-9-6-13-11-16/h6,9,11-12,14H,3-5,7-8,10H2,1-2H3.
What are the key properties of 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole?
1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole has a molecular weight of 289.40 g/mol, XLogP of -0.35, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[3-(ethylamino)propyl-methylsulfamoyl]amino]ethyl]imidazole is sourced from PubChem (CID 106018170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).