2-(diethylsulfamoylamino)propane

C7H18N2O2S — CID 53256756

IUPAC2-(diethylsulfamoylamino)propane
SMILESCCN(CC)S(=O)(=O)NC(C)C
InChIInChI=1S/C7H18N2O2S/c1-5-9(6-2)12(10,11)8-7(3)4/h7-8H,5-6H2,1-4H3
InChIKeyBMPLKMYSNOSSGG-UHFFFAOYSA-N
MW194.30 g/mol
LogP0.57
Rot. Bonds5

About 2-(diethylsulfamoylamino)propane

2-(diethylsulfamoylamino)propane (PubChem CID 53256756) has the molecular formula C7H18N2O2S and a molecular weight of 194.30 g/mol. Its IUPAC name is 2-(diethylsulfamoylamino)propane.

Molecular Properties

Compound Name2-(diethylsulfamoylamino)propane
PubChem CID53256756
Molecular FormulaC7H18N2O2S
Molecular Weight194.30 g/mol
Exact Mass194.11
IUPAC Name2-(diethylsulfamoylamino)propane
SMILESCCN(CC)S(=O)(=O)NC(C)C
InChIInChI=1S/C7H18N2O2S/c1-5-9(6-2)12(10,11)8-7(3)4/h7-8H,5-6H2,1-4H3
InChIKeyBMPLKMYSNOSSGG-UHFFFAOYSA-N
XLogP0.57
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(diethylsulfamoylamino)propane?
The IUPAC name of 2-(diethylsulfamoylamino)propane (CID 53256756) is 2-(diethylsulfamoylamino)propane.
What is the SMILES notation for 2-(diethylsulfamoylamino)propane?
The canonical SMILES for 2-(diethylsulfamoylamino)propane is CCN(CC)S(=O)(=O)NC(C)C.
What is the InChIKey of 2-(diethylsulfamoylamino)propane?
The InChIKey is BMPLKMYSNOSSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O2S/c1-5-9(6-2)12(10,11)8-7(3)4/h7-8H,5-6H2,1-4H3.
What are the key properties of 2-(diethylsulfamoylamino)propane?
2-(diethylsulfamoylamino)propane has a molecular weight of 194.30 g/mol, XLogP of 0.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylsulfamoylamino)propane is sourced from PubChem (CID 53256756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).