1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane

C6H18N4O2S — CID 155056416

IUPAC1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane
SMILESCCN(CCN)S(=O)(=O)NCCN
InChIInChI=1S/C6H18N4O2S/c1-2-10(6-4-8)13(11,12)9-5-3-7/h9H,2-8H2,1H3
InChIKeyNNKRBAYVWKPSNJ-UHFFFAOYSA-N
MW210.30 g/mol
LogP-1.94
Rot. Bonds7

About 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane

1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane (PubChem CID 155056416) has the molecular formula C6H18N4O2S and a molecular weight of 210.30 g/mol. Its IUPAC name is 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane.

Molecular Properties

Compound Name1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane
PubChem CID155056416
Molecular FormulaC6H18N4O2S
Molecular Weight210.30 g/mol
Exact Mass210.12
IUPAC Name1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane
SMILESCCN(CCN)S(=O)(=O)NCCN
InChIInChI=1S/C6H18N4O2S/c1-2-10(6-4-8)13(11,12)9-5-3-7/h9H,2-8H2,1H3
InChIKeyNNKRBAYVWKPSNJ-UHFFFAOYSA-N
XLogP-1.94
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 5-1.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane?
The IUPAC name of 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane (CID 155056416) is 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane.
What is the SMILES notation for 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane?
The canonical SMILES for 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane is CCN(CCN)S(=O)(=O)NCCN.
What is the InChIKey of 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane?
The InChIKey is NNKRBAYVWKPSNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N4O2S/c1-2-10(6-4-8)13(11,12)9-5-3-7/h9H,2-8H2,1H3.
What are the key properties of 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane?
1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane has a molecular weight of 210.30 g/mol, XLogP of -1.94, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-[[2-aminoethyl(ethyl)sulfamoyl]amino]ethane is sourced from PubChem (CID 155056416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).