2-(dimethylamino)-1-(dimethylsulfamoylamino)propane

C7H19N3O2S — CID 126622062

IUPAC2-(dimethylamino)-1-(dimethylsulfamoylamino)propane
SMILESCC(CNS(=O)(=O)N(C)C)N(C)C
InChIInChI=1S/C7H19N3O2S/c1-7(9(2)3)6-8-13(11,12)10(4)5/h7-8H,6H2,1-5H3
InChIKeyWXABYWHTCWUHOA-UHFFFAOYSA-N
MW209.31 g/mol
LogP-0.67
Rot. Bonds5

About 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane

2-(dimethylamino)-1-(dimethylsulfamoylamino)propane (PubChem CID 126622062) has the molecular formula C7H19N3O2S and a molecular weight of 209.31 g/mol. Its IUPAC name is 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane.

Molecular Properties

Compound Name2-(dimethylamino)-1-(dimethylsulfamoylamino)propane
PubChem CID126622062
Molecular FormulaC7H19N3O2S
Molecular Weight209.31 g/mol
Exact Mass209.12
IUPAC Name2-(dimethylamino)-1-(dimethylsulfamoylamino)propane
SMILESCC(CNS(=O)(=O)N(C)C)N(C)C
InChIInChI=1S/C7H19N3O2S/c1-7(9(2)3)6-8-13(11,12)10(4)5/h7-8H,6H2,1-5H3
InChIKeyWXABYWHTCWUHOA-UHFFFAOYSA-N
XLogP-0.67
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane?
The IUPAC name of 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane (CID 126622062) is 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane.
What is the SMILES notation for 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane?
The canonical SMILES for 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane is CC(CNS(=O)(=O)N(C)C)N(C)C.
What is the InChIKey of 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane?
The InChIKey is WXABYWHTCWUHOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3O2S/c1-7(9(2)3)6-8-13(11,12)10(4)5/h7-8H,6H2,1-5H3.
What are the key properties of 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane?
2-(dimethylamino)-1-(dimethylsulfamoylamino)propane has a molecular weight of 209.31 g/mol, XLogP of -0.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-(dimethylsulfamoylamino)propane is sourced from PubChem (CID 126622062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).