2-amino-1-(dimethylsulfamoylamino)propane

C5H15N3O2S — CID 12054402

IUPAC2-amino-1-(dimethylsulfamoylamino)propane
SMILESCC(N)CNS(=O)(=O)N(C)C
InChIInChI=1S/C5H15N3O2S/c1-5(6)4-7-11(9,10)8(2)3/h5,7H,4,6H2,1-3H3
InChIKeyAHTCPLSZKUVXMO-UHFFFAOYSA-N
MW181.26 g/mol
LogP-1.27
Rot. Bonds4

About 2-amino-1-(dimethylsulfamoylamino)propane

2-amino-1-(dimethylsulfamoylamino)propane (PubChem CID 12054402) has the molecular formula C5H15N3O2S and a molecular weight of 181.26 g/mol. Its IUPAC name is 2-amino-1-(dimethylsulfamoylamino)propane.

Molecular Properties

Compound Name2-amino-1-(dimethylsulfamoylamino)propane
PubChem CID12054402
Molecular FormulaC5H15N3O2S
Molecular Weight181.26 g/mol
Exact Mass181.09
IUPAC Name2-amino-1-(dimethylsulfamoylamino)propane
SMILESCC(N)CNS(=O)(=O)N(C)C
InChIInChI=1S/C5H15N3O2S/c1-5(6)4-7-11(9,10)8(2)3/h5,7H,4,6H2,1-3H3
InChIKeyAHTCPLSZKUVXMO-UHFFFAOYSA-N
XLogP-1.27
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 5-1.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(dimethylsulfamoylamino)propane?
The IUPAC name of 2-amino-1-(dimethylsulfamoylamino)propane (CID 12054402) is 2-amino-1-(dimethylsulfamoylamino)propane.
What is the SMILES notation for 2-amino-1-(dimethylsulfamoylamino)propane?
The canonical SMILES for 2-amino-1-(dimethylsulfamoylamino)propane is CC(N)CNS(=O)(=O)N(C)C.
What is the InChIKey of 2-amino-1-(dimethylsulfamoylamino)propane?
The InChIKey is AHTCPLSZKUVXMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15N3O2S/c1-5(6)4-7-11(9,10)8(2)3/h5,7H,4,6H2,1-3H3.
What are the key properties of 2-amino-1-(dimethylsulfamoylamino)propane?
2-amino-1-(dimethylsulfamoylamino)propane has a molecular weight of 181.26 g/mol, XLogP of -1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(dimethylsulfamoylamino)propane is sourced from PubChem (CID 12054402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).