3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane

C11H25N3O2S — CID 79359045

IUPAC3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane
SMILESCN(CCCN)S(=O)(=O)NC1C(C)(C)C1(C)C
InChIInChI=1S/C11H25N3O2S/c1-10(2)9(11(10,3)4)13-17(15,16)14(5)8-6-7-12/h9,13H,6-8,12H2,1-5H3
InChIKeySHANWMOQZKRKES-UHFFFAOYSA-N
MW263.41 g/mol
LogP0.54
Rot. Bonds6

About 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane

3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane (PubChem CID 79359045) has the molecular formula C11H25N3O2S and a molecular weight of 263.41 g/mol. Its IUPAC name is 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane.

Molecular Properties

Compound Name3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane
PubChem CID79359045
Molecular FormulaC11H25N3O2S
Molecular Weight263.41 g/mol
Exact Mass263.17
IUPAC Name3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane
SMILESCN(CCCN)S(=O)(=O)NC1C(C)(C)C1(C)C
InChIInChI=1S/C11H25N3O2S/c1-10(2)9(11(10,3)4)13-17(15,16)14(5)8-6-7-12/h9,13H,6-8,12H2,1-5H3
InChIKeySHANWMOQZKRKES-UHFFFAOYSA-N
XLogP0.54
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane?
The IUPAC name of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane (CID 79359045) is 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane.
What is the SMILES notation for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane?
The canonical SMILES for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane is CN(CCCN)S(=O)(=O)NC1C(C)(C)C1(C)C.
What is the InChIKey of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane?
The InChIKey is SHANWMOQZKRKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S/c1-10(2)9(11(10,3)4)13-17(15,16)14(5)8-6-7-12/h9,13H,6-8,12H2,1-5H3.
What are the key properties of 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane?
3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane has a molecular weight of 263.41 g/mol, XLogP of 0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-aminopropyl(methyl)sulfamoyl]amino]-1,1,2,2-tetramethylcyclopropane is sourced from PubChem (CID 79359045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).