2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium

C8H8N3OY- — CID 135968009

IUPAC2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium
SMILESCc1nc2c(C)n[c-]cn2c1O.[Y]
InChIInChI=1S/C8H8N3O.Y/c1-5-7-10-6(2)8(12)11(7)4-3-9-5;/h4,12H,1-2H3;/q-1;
InChIKeyPSEAAGDARGMXMO-UHFFFAOYSA-N
MW251.08 g/mol
LogP0.85
Rot. Bonds

About 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium

2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium (PubChem CID 135968009) has the molecular formula C8H8N3OY- and a molecular weight of 251.08 g/mol. Its IUPAC name is 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium.

Molecular Properties

Compound Name2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium
PubChem CID135968009
Molecular FormulaC8H8N3OY-
Molecular Weight251.08 g/mol
Exact Mass250.97
IUPAC Name2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium
SMILESCc1nc2c(C)n[c-]cn2c1O.[Y]
InChIInChI=1S/C8H8N3O.Y/c1-5-7-10-6(2)8(12)11(7)4-3-9-5;/h4,12H,1-2H3;/q-1;
InChIKeyPSEAAGDARGMXMO-UHFFFAOYSA-N
XLogP0.85
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.08
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium?
The IUPAC name of 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium (CID 135968009) is 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium.
What is the SMILES notation for 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium?
The canonical SMILES for 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium is Cc1nc2c(C)n[c-]cn2c1O.[Y].
What is the InChIKey of 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium?
The InChIKey is PSEAAGDARGMXMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N3O.Y/c1-5-7-10-6(2)8(12)11(7)4-3-9-5;/h4,12H,1-2H3;/q-1;.
What are the key properties of 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium?
2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium has a molecular weight of 251.08 g/mol, XLogP of 0.85, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethyl-6H-imidazo[1,2-a]pyrazin-6-id-3-ol;yttrium is sourced from PubChem (CID 135968009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).