N-(dimethylsulfamoyl)-N-methylaniline

C9H14N2O2S — CID 669951

IUPACN-(dimethylsulfamoyl)-N-methylaniline
SMILESCN(C)S(=O)(=O)N(C)c1ccccc1
InChIInChI=1S/C9H14N2O2S/c1-10(2)14(12,13)11(3)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKeyXJUSNQYSFYAXCG-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.93
Rot. Bonds3

About N-(dimethylsulfamoyl)-N-methylaniline

N-(dimethylsulfamoyl)-N-methylaniline (PubChem CID 669951) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is N-(dimethylsulfamoyl)-N-methylaniline.

Molecular Properties

Compound NameN-(dimethylsulfamoyl)-N-methylaniline
PubChem CID669951
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC NameN-(dimethylsulfamoyl)-N-methylaniline
SMILESCN(C)S(=O)(=O)N(C)c1ccccc1
InChIInChI=1S/C9H14N2O2S/c1-10(2)14(12,13)11(3)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKeyXJUSNQYSFYAXCG-UHFFFAOYSA-N
XLogP0.93
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(dimethylsulfamoyl)-N-methylaniline?
The IUPAC name of N-(dimethylsulfamoyl)-N-methylaniline (CID 669951) is N-(dimethylsulfamoyl)-N-methylaniline.
What is the SMILES notation for N-(dimethylsulfamoyl)-N-methylaniline?
The canonical SMILES for N-(dimethylsulfamoyl)-N-methylaniline is CN(C)S(=O)(=O)N(C)c1ccccc1.
What is the InChIKey of N-(dimethylsulfamoyl)-N-methylaniline?
The InChIKey is XJUSNQYSFYAXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-10(2)14(12,13)11(3)9-7-5-4-6-8-9/h4-8H,1-3H3.
What are the key properties of N-(dimethylsulfamoyl)-N-methylaniline?
N-(dimethylsulfamoyl)-N-methylaniline has a molecular weight of 214.29 g/mol, XLogP of 0.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylsulfamoyl)-N-methylaniline is sourced from PubChem (CID 669951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).