6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole

C15H18N2S — CID 91244066

IUPAC6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole
SMILESc1cn2cc(C34CC5CC(CC(C5)C3)C4)nc2s1
InChIInChI=1S/C15H18N2S/c1-2-18-14-16-13(9-17(1)14)15-6-10-3-11(7-15)5-12(4-10)8-15/h1-2,9-12H,3-8H2
InChIKeySYYAENPHJGCLFK-UHFFFAOYSA-N
MW258.39 g/mol
LogP3.86
Rot. Bonds1

About 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole

6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole (PubChem CID 91244066) has the molecular formula C15H18N2S and a molecular weight of 258.39 g/mol. Its IUPAC name is 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole
PubChem CID91244066
Molecular FormulaC15H18N2S
Molecular Weight258.39 g/mol
Exact Mass258.12
IUPAC Name6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole
SMILESc1cn2cc(C34CC5CC(CC(C5)C3)C4)nc2s1
InChIInChI=1S/C15H18N2S/c1-2-18-14-16-13(9-17(1)14)15-6-10-3-11(7-15)5-12(4-10)8-15/h1-2,9-12H,3-8H2
InChIKeySYYAENPHJGCLFK-UHFFFAOYSA-N
XLogP3.86
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole (CID 91244066) is 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole is c1cn2cc(C34CC5CC(CC(C5)C3)C4)nc2s1.
What is the InChIKey of 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole?
The InChIKey is SYYAENPHJGCLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2S/c1-2-18-14-16-13(9-17(1)14)15-6-10-3-11(7-15)5-12(4-10)8-15/h1-2,9-12H,3-8H2.
What are the key properties of 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole?
6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole has a molecular weight of 258.39 g/mol, XLogP of 3.86, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-adamantyl)imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 91244066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).