N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine

C8H20N2O2S — CID 118301707

IUPACN-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine
SMILESCC(C)CCN(C)S(=O)(=O)N(C)C
InChIInChI=1S/C8H20N2O2S/c1-8(2)6-7-10(5)13(11,12)9(3)4/h8H,6-7H2,1-5H3
InChIKeyVIZVZALPZYEDDQ-UHFFFAOYSA-N
MW208.33 g/mol
LogP0.77
Rot. Bonds5

About N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine

N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine (PubChem CID 118301707) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine.

Molecular Properties

Compound NameN-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine
PubChem CID118301707
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC NameN-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine
SMILESCC(C)CCN(C)S(=O)(=O)N(C)C
InChIInChI=1S/C8H20N2O2S/c1-8(2)6-7-10(5)13(11,12)9(3)4/h8H,6-7H2,1-5H3
InChIKeyVIZVZALPZYEDDQ-UHFFFAOYSA-N
XLogP0.77
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine?
The IUPAC name of N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine (CID 118301707) is N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine.
What is the SMILES notation for N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine?
The canonical SMILES for N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine is CC(C)CCN(C)S(=O)(=O)N(C)C.
What is the InChIKey of N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine?
The InChIKey is VIZVZALPZYEDDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-8(2)6-7-10(5)13(11,12)9(3)4/h8H,6-7H2,1-5H3.
What are the key properties of N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine?
N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine has a molecular weight of 208.33 g/mol, XLogP of 0.77, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylsulfamoyl)-N,3-dimethylbutan-1-amine is sourced from PubChem (CID 118301707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).