1-(dimethylsulfamoylamino)-3-hydroxybenzene

C8H12N2O3S — CID 7893081

IUPAC1-(dimethylsulfamoylamino)-3-hydroxybenzene
SMILESCN(C)S(=O)(=O)Nc1cccc(O)c1
InChIInChI=1S/C8H12N2O3S/c1-10(2)14(12,13)9-7-4-3-5-8(11)6-7/h3-6,9,11H,1-2H3
InChIKeyAHZQSWQALJXNQV-UHFFFAOYSA-N
MW216.26 g/mol
LogP0.61
Rot. Bonds3

About 1-(dimethylsulfamoylamino)-3-hydroxybenzene

1-(dimethylsulfamoylamino)-3-hydroxybenzene (PubChem CID 7893081) has the molecular formula C8H12N2O3S and a molecular weight of 216.26 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)-3-hydroxybenzene.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)-3-hydroxybenzene
PubChem CID7893081
Molecular FormulaC8H12N2O3S
Molecular Weight216.26 g/mol
Exact Mass216.06
IUPAC Name1-(dimethylsulfamoylamino)-3-hydroxybenzene
SMILESCN(C)S(=O)(=O)Nc1cccc(O)c1
InChIInChI=1S/C8H12N2O3S/c1-10(2)14(12,13)9-7-4-3-5-8(11)6-7/h3-6,9,11H,1-2H3
InChIKeyAHZQSWQALJXNQV-UHFFFAOYSA-N
XLogP0.61
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)-3-hydroxybenzene?
The IUPAC name of 1-(dimethylsulfamoylamino)-3-hydroxybenzene (CID 7893081) is 1-(dimethylsulfamoylamino)-3-hydroxybenzene.
What is the SMILES notation for 1-(dimethylsulfamoylamino)-3-hydroxybenzene?
The canonical SMILES for 1-(dimethylsulfamoylamino)-3-hydroxybenzene is CN(C)S(=O)(=O)Nc1cccc(O)c1.
What is the InChIKey of 1-(dimethylsulfamoylamino)-3-hydroxybenzene?
The InChIKey is AHZQSWQALJXNQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3S/c1-10(2)14(12,13)9-7-4-3-5-8(11)6-7/h3-6,9,11H,1-2H3.
What are the key properties of 1-(dimethylsulfamoylamino)-3-hydroxybenzene?
1-(dimethylsulfamoylamino)-3-hydroxybenzene has a molecular weight of 216.26 g/mol, XLogP of 0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)-3-hydroxybenzene is sourced from PubChem (CID 7893081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).