[[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane

C8H19N3O2S — CID 114803733

IUPAC[[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane
SMILESCCCN(CCN)S(=O)(=O)NC1CC1
InChIInChI=1S/C8H19N3O2S/c1-2-6-11(7-5-9)14(12,13)10-8-3-4-8/h8,10H,2-7,9H2,1H3
InChIKeyOXSZMJTZIIYSCV-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.35
Rot. Bonds7

About [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane

[[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane (PubChem CID 114803733) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane.

Molecular Properties

Compound Name[[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane
PubChem CID114803733
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC Name[[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane
SMILESCCCN(CCN)S(=O)(=O)NC1CC1
InChIInChI=1S/C8H19N3O2S/c1-2-6-11(7-5-9)14(12,13)10-8-3-4-8/h8,10H,2-7,9H2,1H3
InChIKeyOXSZMJTZIIYSCV-UHFFFAOYSA-N
XLogP-0.35
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane?
The IUPAC name of [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane (CID 114803733) is [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane.
What is the SMILES notation for [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane?
The canonical SMILES for [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane is CCCN(CCN)S(=O)(=O)NC1CC1.
What is the InChIKey of [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane?
The InChIKey is OXSZMJTZIIYSCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c1-2-6-11(7-5-9)14(12,13)10-8-3-4-8/h8,10H,2-7,9H2,1H3.
What are the key properties of [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane?
[[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane has a molecular weight of 221.33 g/mol, XLogP of -0.35, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[2-aminoethyl(propyl)sulfamoyl]amino]cyclopropane is sourced from PubChem (CID 114803733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).