5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole

C15H14N2S — CID 59225916

IUPAC5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole
SMILESCSc1ncc(C)n1-c1cccc2ccccc12
InChIInChI=1S/C15H14N2S/c1-11-10-16-15(18-2)17(11)14-9-5-7-12-6-3-4-8-13(12)14/h3-10H,1-2H3
InChIKeyOUESIBPIRXGPDH-UHFFFAOYSA-N
MW254.36 g/mol
LogP4.06
Rot. Bonds2

About 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole

5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole (PubChem CID 59225916) has the molecular formula C15H14N2S and a molecular weight of 254.36 g/mol. Its IUPAC name is 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole.

Molecular Properties

Compound Name5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole
PubChem CID59225916
Molecular FormulaC15H14N2S
Molecular Weight254.36 g/mol
Exact Mass254.09
IUPAC Name5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole
SMILESCSc1ncc(C)n1-c1cccc2ccccc12
InChIInChI=1S/C15H14N2S/c1-11-10-16-15(18-2)17(11)14-9-5-7-12-6-3-4-8-13(12)14/h3-10H,1-2H3
InChIKeyOUESIBPIRXGPDH-UHFFFAOYSA-N
XLogP4.06
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole 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 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole?
The IUPAC name of 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole (CID 59225916) is 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole.
What is the SMILES notation for 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole?
The canonical SMILES for 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole is CSc1ncc(C)n1-c1cccc2ccccc12.
What is the InChIKey of 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole?
The InChIKey is OUESIBPIRXGPDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2S/c1-11-10-16-15(18-2)17(11)14-9-5-7-12-6-3-4-8-13(12)14/h3-10H,1-2H3.
What are the key properties of 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole?
5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole has a molecular weight of 254.36 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-methylsulfanyl-1-naphthalen-1-ylimidazole is sourced from PubChem (CID 59225916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).