6-amino-N-methylnaphthalene-2-sulfonamide

C11H12N2O2S — CID 3034961

IUPAC6-amino-N-methylnaphthalene-2-sulfonamide
SMILESCNS(=O)(=O)c1ccc2cc(N)ccc2c1
InChIInChI=1S/C11H12N2O2S/c1-13-16(14,15)11-5-3-8-6-10(12)4-2-9(8)7-11/h2-7,13H,12H2,1H3
InChIKeyRBQODZRXIYFUJS-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.33
Rot. Bonds2

About 6-amino-N-methylnaphthalene-2-sulfonamide

6-amino-N-methylnaphthalene-2-sulfonamide (PubChem CID 3034961) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is 6-amino-N-methylnaphthalene-2-sulfonamide.

Molecular Properties

Compound Name6-amino-N-methylnaphthalene-2-sulfonamide
PubChem CID3034961
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC Name6-amino-N-methylnaphthalene-2-sulfonamide
SMILESCNS(=O)(=O)c1ccc2cc(N)ccc2c1
InChIInChI=1S/C11H12N2O2S/c1-13-16(14,15)11-5-3-8-6-10(12)4-2-9(8)7-11/h2-7,13H,12H2,1H3
InChIKeyRBQODZRXIYFUJS-UHFFFAOYSA-N
XLogP1.33
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-methylnaphthalene-2-sulfonamide?
The IUPAC name of 6-amino-N-methylnaphthalene-2-sulfonamide (CID 3034961) is 6-amino-N-methylnaphthalene-2-sulfonamide.
What is the SMILES notation for 6-amino-N-methylnaphthalene-2-sulfonamide?
The canonical SMILES for 6-amino-N-methylnaphthalene-2-sulfonamide is CNS(=O)(=O)c1ccc2cc(N)ccc2c1.
What is the InChIKey of 6-amino-N-methylnaphthalene-2-sulfonamide?
The InChIKey is RBQODZRXIYFUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c1-13-16(14,15)11-5-3-8-6-10(12)4-2-9(8)7-11/h2-7,13H,12H2,1H3.
What are the key properties of 6-amino-N-methylnaphthalene-2-sulfonamide?
6-amino-N-methylnaphthalene-2-sulfonamide has a molecular weight of 236.30 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-methylnaphthalene-2-sulfonamide is sourced from PubChem (CID 3034961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).