1-(dimethylsulfamoylamino)-4-ethylbenzene

C10H16N2O2S — CID 885193

IUPAC1-(dimethylsulfamoylamino)-4-ethylbenzene
SMILESCCc1ccc(NS(=O)(=O)N(C)C)cc1
InChIInChI=1S/C10H16N2O2S/c1-4-9-5-7-10(8-6-9)11-15(13,14)12(2)3/h5-8,11H,4H2,1-3H3
InChIKeyPVEPXTFHWADVQC-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.47
Rot. Bonds4

About 1-(dimethylsulfamoylamino)-4-ethylbenzene

1-(dimethylsulfamoylamino)-4-ethylbenzene (PubChem CID 885193) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)-4-ethylbenzene.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)-4-ethylbenzene
PubChem CID885193
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name1-(dimethylsulfamoylamino)-4-ethylbenzene
SMILESCCc1ccc(NS(=O)(=O)N(C)C)cc1
InChIInChI=1S/C10H16N2O2S/c1-4-9-5-7-10(8-6-9)11-15(13,14)12(2)3/h5-8,11H,4H2,1-3H3
InChIKeyPVEPXTFHWADVQC-UHFFFAOYSA-N
XLogP1.47
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)-4-ethylbenzene?
The IUPAC name of 1-(dimethylsulfamoylamino)-4-ethylbenzene (CID 885193) is 1-(dimethylsulfamoylamino)-4-ethylbenzene.
What is the SMILES notation for 1-(dimethylsulfamoylamino)-4-ethylbenzene?
The canonical SMILES for 1-(dimethylsulfamoylamino)-4-ethylbenzene is CCc1ccc(NS(=O)(=O)N(C)C)cc1.
What is the InChIKey of 1-(dimethylsulfamoylamino)-4-ethylbenzene?
The InChIKey is PVEPXTFHWADVQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-4-9-5-7-10(8-6-9)11-15(13,14)12(2)3/h5-8,11H,4H2,1-3H3.
What are the key properties of 1-(dimethylsulfamoylamino)-4-ethylbenzene?
1-(dimethylsulfamoylamino)-4-ethylbenzene has a molecular weight of 228.32 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)-4-ethylbenzene is sourced from PubChem (CID 885193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).