2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide

C9H12N2O5S — CID 103890316

IUPAC2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide
SMILESNS(=O)(=O)CCNC(=O)c1c(O)cccc1O
InChIInChI=1S/C9H12N2O5S/c10-17(15,16)5-4-11-9(14)8-6(12)2-1-3-7(8)13/h1-3,12-13H,4-5H2,(H,11,14)(H2,10,15,16)
InChIKeyPHAIFHRXMWHFBB-UHFFFAOYSA-N
MW260.27 g/mol
LogP-0.88
Rot. Bonds4

About 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide

2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide (PubChem CID 103890316) has the molecular formula C9H12N2O5S and a molecular weight of 260.27 g/mol. Its IUPAC name is 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide.

Molecular Properties

Compound Name2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide
PubChem CID103890316
Molecular FormulaC9H12N2O5S
Molecular Weight260.27 g/mol
Exact Mass260.05
IUPAC Name2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide
SMILESNS(=O)(=O)CCNC(=O)c1c(O)cccc1O
InChIInChI=1S/C9H12N2O5S/c10-17(15,16)5-4-11-9(14)8-6(12)2-1-3-7(8)13/h1-3,12-13H,4-5H2,(H,11,14)(H2,10,15,16)
InChIKeyPHAIFHRXMWHFBB-UHFFFAOYSA-N
XLogP-0.88
TPSA129.72 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 5-0.88
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydroxy-N-(2-sulfamoylethyl)benzamide
CID 43552549
2-chloro-6-methoxy-N-(2-sulfamoylethyl)benzamide
CID 138016679
2-hydroxy-3-nitro-N-(2-sulfamoylethyl)benzamide
CID 103800076
N-(2-sulfamoylethyl)naphthalene-1-carboxamide
CID 61067529
2-amino-N-(2-sulfamoylethyl)benzamide
CID 43551552
2,4,6-trimethyl-N-(2-sulfamoylethyl)benzamide
CID 61128957
6-oxo-N-(2-sulfamoylethyl)-1H-pyridine-2-carboxamide
CID 107261803
6-chloro-N-(2-sulfamoylethyl)pyridine-2-carboxamide
CID 62234708
2,6-dihydroxy-N-(2-methoxyethyl)benzamide
CID 103748859
2-amino-3-nitro-N-(2-sulfamoylethyl)benzamide
CID 112699109
N-(2-sulfamoylethyl)-3-(trifluoromethyl)benzamide
CID 61068183
2,6-dihydroxy-N-(2-methylsulfanylethyl)benzamide
CID 103890422

Frequently Asked Questions

What is the IUPAC name of 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide?
The IUPAC name of 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide (CID 103890316) is 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide.
What is the SMILES notation for 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide?
The canonical SMILES for 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide is NS(=O)(=O)CCNC(=O)c1c(O)cccc1O.
What is the InChIKey of 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide?
The InChIKey is PHAIFHRXMWHFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O5S/c10-17(15,16)5-4-11-9(14)8-6(12)2-1-3-7(8)13/h1-3,12-13H,4-5H2,(H,11,14)(H2,10,15,16).
What are the key properties of 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide?
2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide has a molecular weight of 260.27 g/mol, XLogP of -0.88, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dihydroxy-N-(2-sulfamoylethyl)benzamide is sourced from PubChem (CID 103890316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).