5-(sulfamoylamino)-1H-indole

C8H9N3O2S — CID 112573166

IUPAC5-(sulfamoylamino)-1H-indole
SMILESNS(=O)(=O)Nc1ccc2[nH]ccc2c1
InChIInChI=1S/C8H9N3O2S/c9-14(12,13)11-7-1-2-8-6(5-7)3-4-10-8/h1-5,10-11H,(H2,9,12,13)
InChIKeyGGTZSNUFRMSPFH-UHFFFAOYSA-N
MW211.25 g/mol
LogP0.78
Rot. Bonds2

About 5-(sulfamoylamino)-1H-indole

5-(sulfamoylamino)-1H-indole (PubChem CID 112573166) has the molecular formula C8H9N3O2S and a molecular weight of 211.25 g/mol. Its IUPAC name is 5-(sulfamoylamino)-1H-indole.

Molecular Properties

Compound Name5-(sulfamoylamino)-1H-indole
PubChem CID112573166
Molecular FormulaC8H9N3O2S
Molecular Weight211.25 g/mol
Exact Mass211.04
IUPAC Name5-(sulfamoylamino)-1H-indole
SMILESNS(=O)(=O)Nc1ccc2[nH]ccc2c1
InChIInChI=1S/C8H9N3O2S/c9-14(12,13)11-7-1-2-8-6(5-7)3-4-10-8/h1-5,10-11H,(H2,9,12,13)
InChIKeyGGTZSNUFRMSPFH-UHFFFAOYSA-N
XLogP0.78
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(sulfamoylamino)-1H-indole?
The IUPAC name of 5-(sulfamoylamino)-1H-indole (CID 112573166) is 5-(sulfamoylamino)-1H-indole.
What is the SMILES notation for 5-(sulfamoylamino)-1H-indole?
The canonical SMILES for 5-(sulfamoylamino)-1H-indole is NS(=O)(=O)Nc1ccc2[nH]ccc2c1.
What is the InChIKey of 5-(sulfamoylamino)-1H-indole?
The InChIKey is GGTZSNUFRMSPFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2S/c9-14(12,13)11-7-1-2-8-6(5-7)3-4-10-8/h1-5,10-11H,(H2,9,12,13).
What are the key properties of 5-(sulfamoylamino)-1H-indole?
5-(sulfamoylamino)-1H-indole has a molecular weight of 211.25 g/mol, XLogP of 0.78, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(sulfamoylamino)-1H-indole is sourced from PubChem (CID 112573166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).