1-(dimethylamino)-3-(dimethylsulfamoylamino)propane

C7H19N3O2S — CID 3519490

IUPAC1-(dimethylamino)-3-(dimethylsulfamoylamino)propane
SMILESCN(C)CCCNS(=O)(=O)N(C)C
InChIInChI=1S/C7H19N3O2S/c1-9(2)7-5-6-8-13(11,12)10(3)4/h8H,5-7H2,1-4H3
InChIKeyOBDVGOAWLYFJFG-UHFFFAOYSA-N
MW209.31 g/mol
LogP-0.67
Rot. Bonds6

About 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane

1-(dimethylamino)-3-(dimethylsulfamoylamino)propane (PubChem CID 3519490) has the molecular formula C7H19N3O2S and a molecular weight of 209.31 g/mol. Its IUPAC name is 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane.

Molecular Properties

Compound Name1-(dimethylamino)-3-(dimethylsulfamoylamino)propane
PubChem CID3519490
Molecular FormulaC7H19N3O2S
Molecular Weight209.31 g/mol
Exact Mass209.12
IUPAC Name1-(dimethylamino)-3-(dimethylsulfamoylamino)propane
SMILESCN(C)CCCNS(=O)(=O)N(C)C
InChIInChI=1S/C7H19N3O2S/c1-9(2)7-5-6-8-13(11,12)10(3)4/h8H,5-7H2,1-4H3
InChIKeyOBDVGOAWLYFJFG-UHFFFAOYSA-N
XLogP-0.67
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Methyl-[1,2,6]thiadiazinane 1,1-dioxide
CID 10080560
N-[3-(dimethylamino)propylsulfamoyl]-N',N'-dimethylpropane-1,3-diamine
CID 53316867
N-[3-(diethylamino)propylsulfamoyl]-N',N'-diethylpropane-1,3-diamine
CID 53320822
3-(Fluorosulfonylamino)propyl-trimethylazanium
CID 130266408
3-(Fluorosulfonylamino)propyl-(iodomethyl)-dimethylazanium
CID 130266530
N-[3-(dimethylamino)propyl]sulfamoyl fluoride
CID 145796876
N'-methyl-N'-[methyl(2,2,2-trifluoroethyl)sulfamoyl]propane-1,3-diamine
CID 61456649
3-[[3-Aminopropyl(methyl)sulfamoyl]amino]-1,1,1-trifluoropropane
CID 63226678
N'-[2,2-difluoroethyl(methyl)sulfamoyl]-N'-methylpropane-1,3-diamine
CID 116314790
1-(Dimethylsulfamoylamino)butane
CID 3523339
1-(Dimethylsulfamoylamino)propane
CID 4474211
N-[3-(dimethylamino)propyl]methanesulfonamide
CID 4649199

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane?
The IUPAC name of 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane (CID 3519490) is 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane.
What is the SMILES notation for 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane?
The canonical SMILES for 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane is CN(C)CCCNS(=O)(=O)N(C)C.
What is the InChIKey of 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane?
The InChIKey is OBDVGOAWLYFJFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3O2S/c1-9(2)7-5-6-8-13(11,12)10(3)4/h8H,5-7H2,1-4H3.
What are the key properties of 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane?
1-(dimethylamino)-3-(dimethylsulfamoylamino)propane has a molecular weight of 209.31 g/mol, XLogP of -0.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-3-(dimethylsulfamoylamino)propane is sourced from PubChem (CID 3519490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).