2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol

C12H12N2OS — CID 11658692

IUPAC2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol
SMILESCc1ccc(O)c(C2=CSC3=NCCN23)c1
InChIInChI=1S/C12H12N2OS/c1-8-2-3-11(15)9(6-8)10-7-16-12-13-4-5-14(10)12/h2-3,6-7,15H,4-5H2,1H3
InChIKeyVXAAXQGULJDERT-UHFFFAOYSA-N
MW232.31 g/mol
LogP2.42
Rot. Bonds1

About 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol

2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol (PubChem CID 11658692) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol.

Molecular Properties

Compound Name2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol
PubChem CID11658692
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC Name2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol
SMILESCc1ccc(O)c(C2=CSC3=NCCN23)c1
InChIInChI=1S/C12H12N2OS/c1-8-2-3-11(15)9(6-8)10-7-16-12-13-4-5-14(10)12/h2-3,6-7,15H,4-5H2,1H3
InChIKeyVXAAXQGULJDERT-UHFFFAOYSA-N
XLogP2.42
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol?
The IUPAC name of 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol (CID 11658692) is 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol.
What is the SMILES notation for 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol?
The canonical SMILES for 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol is Cc1ccc(O)c(C2=CSC3=NCCN23)c1.
What is the InChIKey of 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol?
The InChIKey is VXAAXQGULJDERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS/c1-8-2-3-11(15)9(6-8)10-7-16-12-13-4-5-14(10)12/h2-3,6-7,15H,4-5H2,1H3.
What are the key properties of 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol?
2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol has a molecular weight of 232.31 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-4-methylphenol is sourced from PubChem (CID 11658692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).