3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole

C16H12N2S — CID 68740034

IUPAC3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole
SMILESCc1csc2nc(-c3cccc4ccccc34)cn12
InChIInChI=1S/C16H12N2S/c1-11-10-19-16-17-15(9-18(11)16)14-8-4-6-12-5-2-3-7-13(12)14/h2-10H,1H3
InChIKeyKRAOLPTYFMCWMQ-UHFFFAOYSA-N
MW264.35 g/mol
LogP4.52
Rot. Bonds1

About 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole

3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole (PubChem CID 68740034) has the molecular formula C16H12N2S and a molecular weight of 264.35 g/mol. Its IUPAC name is 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole
PubChem CID68740034
Molecular FormulaC16H12N2S
Molecular Weight264.35 g/mol
Exact Mass264.07
IUPAC Name3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole
SMILESCc1csc2nc(-c3cccc4ccccc34)cn12
InChIInChI=1S/C16H12N2S/c1-11-10-19-16-17-15(9-18(11)16)14-8-4-6-12-5-2-3-7-13(12)14/h2-10H,1H3
InChIKeyKRAOLPTYFMCWMQ-UHFFFAOYSA-N
XLogP4.52
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole (CID 68740034) is 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole is Cc1csc2nc(-c3cccc4ccccc34)cn12.
What is the InChIKey of 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole?
The InChIKey is KRAOLPTYFMCWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2S/c1-11-10-19-16-17-15(9-18(11)16)14-8-4-6-12-5-2-3-7-13(12)14/h2-10H,1H3.
What are the key properties of 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole?
3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole has a molecular weight of 264.35 g/mol, XLogP of 4.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-naphthalen-1-ylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 68740034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).