2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol

C13H12N2OS — CID 14801972

IUPAC2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol
SMILESCc1nc2sccn2c1Cc1ccccc1O
InChIInChI=1S/C13H12N2OS/c1-9-11(15-6-7-17-13(15)14-9)8-10-4-2-3-5-12(10)16/h2-7,16H,8H2,1H3
InChIKeyOJCURIJIRTVBFT-UHFFFAOYSA-N
MW244.32 g/mol
LogP3.00
Rot. Bonds2

About 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol

2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol (PubChem CID 14801972) has the molecular formula C13H12N2OS and a molecular weight of 244.32 g/mol. Its IUPAC name is 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol.

Molecular Properties

Compound Name2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol
PubChem CID14801972
Molecular FormulaC13H12N2OS
Molecular Weight244.32 g/mol
Exact Mass244.07
IUPAC Name2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol
SMILESCc1nc2sccn2c1Cc1ccccc1O
InChIInChI=1S/C13H12N2OS/c1-9-11(15-6-7-17-13(15)14-9)8-10-4-2-3-5-12(10)16/h2-7,16H,8H2,1H3
InChIKeyOJCURIJIRTVBFT-UHFFFAOYSA-N
XLogP3.00
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol?
The IUPAC name of 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol (CID 14801972) is 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol.
What is the SMILES notation for 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol?
The canonical SMILES for 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol is Cc1nc2sccn2c1Cc1ccccc1O.
What is the InChIKey of 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol?
The InChIKey is OJCURIJIRTVBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2OS/c1-9-11(15-6-7-17-13(15)14-9)8-10-4-2-3-5-12(10)16/h2-7,16H,8H2,1H3.
What are the key properties of 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol?
2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol has a molecular weight of 244.32 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]phenol is sourced from PubChem (CID 14801972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).