(sulfamoylamino)benzene

C6H8N2O2S — CID 15569631

IUPAC(sulfamoylamino)benzene
SMILESNS(=O)(=O)Nc1ccccc1
InChIInChI=1S/C6H8N2O2S/c7-11(9,10)8-6-4-2-1-3-5-6/h1-5,8H,(H2,7,9,10)
InChIKeyDEVUYWTZRXOMSI-UHFFFAOYSA-N
MW172.21 g/mol
LogP0.30
Rot. Bonds2

About (sulfamoylamino)benzene

(sulfamoylamino)benzene (PubChem CID 15569631) has the molecular formula C6H8N2O2S and a molecular weight of 172.21 g/mol. Its IUPAC name is (sulfamoylamino)benzene.

Molecular Properties

Compound Name(sulfamoylamino)benzene
PubChem CID15569631
Molecular FormulaC6H8N2O2S
Molecular Weight172.21 g/mol
Exact Mass172.03
IUPAC Name(sulfamoylamino)benzene
SMILESNS(=O)(=O)Nc1ccccc1
InChIInChI=1S/C6H8N2O2S/c7-11(9,10)8-6-4-2-1-3-5-6/h1-5,8H,(H2,7,9,10)
InChIKeyDEVUYWTZRXOMSI-UHFFFAOYSA-N
XLogP0.30
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.21
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (sulfamoylamino)benzene?
The IUPAC name of (sulfamoylamino)benzene (CID 15569631) is (sulfamoylamino)benzene.
What is the SMILES notation for (sulfamoylamino)benzene?
The canonical SMILES for (sulfamoylamino)benzene is NS(=O)(=O)Nc1ccccc1.
What is the InChIKey of (sulfamoylamino)benzene?
The InChIKey is DEVUYWTZRXOMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2S/c7-11(9,10)8-6-4-2-1-3-5-6/h1-5,8H,(H2,7,9,10).
What are the key properties of (sulfamoylamino)benzene?
(sulfamoylamino)benzene has a molecular weight of 172.21 g/mol, XLogP of 0.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (sulfamoylamino)benzene is sourced from PubChem (CID 15569631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).