4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol

C13H11N3O — CID 162633964

IUPAC4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol
SMILESCc1cc(-c2cnc3cnccn23)ccc1O
InChIInChI=1S/C13H11N3O/c1-9-6-10(2-3-12(9)17)11-7-15-13-8-14-4-5-16(11)13/h2-8,17H,1H3
InChIKeyYNEGLYYTSFJFLN-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.41
Rot. Bonds1

About 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol

4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol (PubChem CID 162633964) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol.

Molecular Properties

Compound Name4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol
PubChem CID162633964
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol
SMILESCc1cc(-c2cnc3cnccn23)ccc1O
InChIInChI=1S/C13H11N3O/c1-9-6-10(2-3-12(9)17)11-7-15-13-8-14-4-5-16(11)13/h2-8,17H,1H3
InChIKeyYNEGLYYTSFJFLN-UHFFFAOYSA-N
XLogP2.41
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol?
The IUPAC name of 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol (CID 162633964) is 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol.
What is the SMILES notation for 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol?
The canonical SMILES for 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol is Cc1cc(-c2cnc3cnccn23)ccc1O.
What is the InChIKey of 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol?
The InChIKey is YNEGLYYTSFJFLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-9-6-10(2-3-12(9)17)11-7-15-13-8-14-4-5-16(11)13/h2-8,17H,1H3.
What are the key properties of 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol?
4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol has a molecular weight of 225.25 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[1,2-a]pyrazin-3-yl-2-methylphenol is sourced from PubChem (CID 162633964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).