N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine

C7H20N4O2S — CID 155056327

IUPACN'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine
SMILESCCN(CCN)S(=O)(=O)N(C)CCN
InChIInChI=1S/C7H20N4O2S/c1-3-11(7-5-9)14(12,13)10(2)6-4-8/h3-9H2,1-2H3
InChIKeySDGJXIJTDFNNJL-UHFFFAOYSA-N
MW224.33 g/mol
LogP-1.60
Rot. Bonds7

About N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine

N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine (PubChem CID 155056327) has the molecular formula C7H20N4O2S and a molecular weight of 224.33 g/mol. Its IUPAC name is N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine
PubChem CID155056327
Molecular FormulaC7H20N4O2S
Molecular Weight224.33 g/mol
Exact Mass224.13
IUPAC NameN'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine
SMILESCCN(CCN)S(=O)(=O)N(C)CCN
InChIInChI=1S/C7H20N4O2S/c1-3-11(7-5-9)14(12,13)10(2)6-4-8/h3-9H2,1-2H3
InChIKeySDGJXIJTDFNNJL-UHFFFAOYSA-N
XLogP-1.60
TPSA92.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 5-1.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine?
The IUPAC name of N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine (CID 155056327) is N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine is CCN(CCN)S(=O)(=O)N(C)CCN.
What is the InChIKey of N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine?
The InChIKey is SDGJXIJTDFNNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H20N4O2S/c1-3-11(7-5-9)14(12,13)10(2)6-4-8/h3-9H2,1-2H3.
What are the key properties of N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine?
N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine has a molecular weight of 224.33 g/mol, XLogP of -1.60, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-aminoethyl(ethyl)sulfamoyl]-N'-methylethane-1,2-diamine is sourced from PubChem (CID 155056327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).