1-(dimethylsulfamoylamino)-2-ethoxybenzene

C10H16N2O3S — CID 670172

IUPAC1-(dimethylsulfamoylamino)-2-ethoxybenzene
SMILESCCOc1ccccc1NS(=O)(=O)N(C)C
InChIInChI=1S/C10H16N2O3S/c1-4-15-10-8-6-5-7-9(10)11-16(13,14)12(2)3/h5-8,11H,4H2,1-3H3
InChIKeyYJBMNINUJMYAEJ-UHFFFAOYSA-N
MW244.32 g/mol
LogP1.30
Rot. Bonds5

About 1-(dimethylsulfamoylamino)-2-ethoxybenzene

1-(dimethylsulfamoylamino)-2-ethoxybenzene (PubChem CID 670172) has the molecular formula C10H16N2O3S and a molecular weight of 244.32 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)-2-ethoxybenzene.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)-2-ethoxybenzene
PubChem CID670172
Molecular FormulaC10H16N2O3S
Molecular Weight244.32 g/mol
Exact Mass244.09
IUPAC Name1-(dimethylsulfamoylamino)-2-ethoxybenzene
SMILESCCOc1ccccc1NS(=O)(=O)N(C)C
InChIInChI=1S/C10H16N2O3S/c1-4-15-10-8-6-5-7-9(10)11-16(13,14)12(2)3/h5-8,11H,4H2,1-3H3
InChIKeyYJBMNINUJMYAEJ-UHFFFAOYSA-N
XLogP1.30
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)-2-ethoxybenzene?
The IUPAC name of 1-(dimethylsulfamoylamino)-2-ethoxybenzene (CID 670172) is 1-(dimethylsulfamoylamino)-2-ethoxybenzene.
What is the SMILES notation for 1-(dimethylsulfamoylamino)-2-ethoxybenzene?
The canonical SMILES for 1-(dimethylsulfamoylamino)-2-ethoxybenzene is CCOc1ccccc1NS(=O)(=O)N(C)C.
What is the InChIKey of 1-(dimethylsulfamoylamino)-2-ethoxybenzene?
The InChIKey is YJBMNINUJMYAEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S/c1-4-15-10-8-6-5-7-9(10)11-16(13,14)12(2)3/h5-8,11H,4H2,1-3H3.
What are the key properties of 1-(dimethylsulfamoylamino)-2-ethoxybenzene?
1-(dimethylsulfamoylamino)-2-ethoxybenzene has a molecular weight of 244.32 g/mol, XLogP of 1.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)-2-ethoxybenzene is sourced from PubChem (CID 670172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).