6-hydroxynaphthalene-1,3-disulfonamide

C10H10N2O5S2 — CID 25047825

IUPAC6-hydroxynaphthalene-1,3-disulfonamide
SMILESNS(=O)(=O)c1cc(S(N)(=O)=O)c2ccc(O)cc2c1
InChIInChI=1S/C10H10N2O5S2/c11-18(14,15)8-4-6-3-7(13)1-2-9(6)10(5-8)19(12,16)17/h1-5,13H,(H2,11,14,15)(H2,12,16,17)
InChIKeyVBESAKLGXBJMOB-UHFFFAOYSA-N
MW302.33 g/mol
LogP-0.16
Rot. Bonds2

About 6-hydroxynaphthalene-1,3-disulfonamide

6-hydroxynaphthalene-1,3-disulfonamide (PubChem CID 25047825) has the molecular formula C10H10N2O5S2 and a molecular weight of 302.33 g/mol. Its IUPAC name is 6-hydroxynaphthalene-1,3-disulfonamide.

Molecular Properties

Compound Name6-hydroxynaphthalene-1,3-disulfonamide
PubChem CID25047825
Molecular FormulaC10H10N2O5S2
Molecular Weight302.33 g/mol
Exact Mass302.00
IUPAC Name6-hydroxynaphthalene-1,3-disulfonamide
SMILESNS(=O)(=O)c1cc(S(N)(=O)=O)c2ccc(O)cc2c1
InChIInChI=1S/C10H10N2O5S2/c11-18(14,15)8-4-6-3-7(13)1-2-9(6)10(5-8)19(12,16)17/h1-5,13H,(H2,11,14,15)(H2,12,16,17)
InChIKeyVBESAKLGXBJMOB-UHFFFAOYSA-N
XLogP-0.16
TPSA140.55 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxynaphthalene-1,3-disulfonamide?
The IUPAC name of 6-hydroxynaphthalene-1,3-disulfonamide (CID 25047825) is 6-hydroxynaphthalene-1,3-disulfonamide.
What is the SMILES notation for 6-hydroxynaphthalene-1,3-disulfonamide?
The canonical SMILES for 6-hydroxynaphthalene-1,3-disulfonamide is NS(=O)(=O)c1cc(S(N)(=O)=O)c2ccc(O)cc2c1.
What is the InChIKey of 6-hydroxynaphthalene-1,3-disulfonamide?
The InChIKey is VBESAKLGXBJMOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O5S2/c11-18(14,15)8-4-6-3-7(13)1-2-9(6)10(5-8)19(12,16)17/h1-5,13H,(H2,11,14,15)(H2,12,16,17).
What are the key properties of 6-hydroxynaphthalene-1,3-disulfonamide?
6-hydroxynaphthalene-1,3-disulfonamide has a molecular weight of 302.33 g/mol, XLogP of -0.16, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxynaphthalene-1,3-disulfonamide is sourced from PubChem (CID 25047825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).