1-naphthalen-2-ylsulfonylimidazole

C13H10N2O2S — CID 581487

IUPAC1-naphthalen-2-ylsulfonylimidazole
SMILESO=S(=O)(c1ccc2ccccc2c1)n1ccnc1
InChIInChI=1S/C13H10N2O2S/c16-18(17,15-8-7-14-10-15)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H
InChIKeyJANLJLUTHIIDKV-UHFFFAOYSA-N
MW258.30 g/mol
LogP2.27
Rot. Bonds2

About 1-naphthalen-2-ylsulfonylimidazole

1-naphthalen-2-ylsulfonylimidazole (PubChem CID 581487) has the molecular formula C13H10N2O2S and a molecular weight of 258.30 g/mol. Its IUPAC name is 1-naphthalen-2-ylsulfonylimidazole.

Molecular Properties

Compound Name1-naphthalen-2-ylsulfonylimidazole
PubChem CID581487
Molecular FormulaC13H10N2O2S
Molecular Weight258.30 g/mol
Exact Mass258.05
IUPAC Name1-naphthalen-2-ylsulfonylimidazole
SMILESO=S(=O)(c1ccc2ccccc2c1)n1ccnc1
InChIInChI=1S/C13H10N2O2S/c16-18(17,15-8-7-14-10-15)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H
InChIKeyJANLJLUTHIIDKV-UHFFFAOYSA-N
XLogP2.27
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-naphthalen-2-ylsulfonylimidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-ylsulfonylimidazole?
The IUPAC name of 1-naphthalen-2-ylsulfonylimidazole (CID 581487) is 1-naphthalen-2-ylsulfonylimidazole.
What is the SMILES notation for 1-naphthalen-2-ylsulfonylimidazole?
The canonical SMILES for 1-naphthalen-2-ylsulfonylimidazole is O=S(=O)(c1ccc2ccccc2c1)n1ccnc1.
What is the InChIKey of 1-naphthalen-2-ylsulfonylimidazole?
The InChIKey is JANLJLUTHIIDKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O2S/c16-18(17,15-8-7-14-10-15)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H.
What are the key properties of 1-naphthalen-2-ylsulfonylimidazole?
1-naphthalen-2-ylsulfonylimidazole has a molecular weight of 258.30 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-ylsulfonylimidazole is sourced from PubChem (CID 581487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).