8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile

C15H16N6 — CID 163640888

IUPAC8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile
SMILESCc1ccc(N)cc1C1(C)Cn2c(C#N)cnc2C(N)=N1
InChIInChI=1S/C15H16N6/c1-9-3-4-10(17)5-12(9)15(2)8-21-11(6-16)7-19-14(21)13(18)20-15/h3-5,7H,8,17H2,1-2H3,(H2,18,20)
InChIKeyIEDXGCLMUQCQBV-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.28
Rot. Bonds1

About 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile

8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile (PubChem CID 163640888) has the molecular formula C15H16N6 and a molecular weight of 280.34 g/mol. Its IUPAC name is 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile.

Molecular Properties

Compound Name8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile
PubChem CID163640888
Molecular FormulaC15H16N6
Molecular Weight280.34 g/mol
Exact Mass280.14
IUPAC Name8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile
SMILESCc1ccc(N)cc1C1(C)Cn2c(C#N)cnc2C(N)=N1
InChIInChI=1S/C15H16N6/c1-9-3-4-10(17)5-12(9)15(2)8-21-11(6-16)7-19-14(21)13(18)20-15/h3-5,7H,8,17H2,1-2H3,(H2,18,20)
InChIKeyIEDXGCLMUQCQBV-UHFFFAOYSA-N
XLogP1.28
TPSA106.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile?
The IUPAC name of 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile (CID 163640888) is 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile.
What is the SMILES notation for 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile?
The canonical SMILES for 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile is Cc1ccc(N)cc1C1(C)Cn2c(C#N)cnc2C(N)=N1.
What is the InChIKey of 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile?
The InChIKey is IEDXGCLMUQCQBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6/c1-9-3-4-10(17)5-12(9)15(2)8-21-11(6-16)7-19-14(21)13(18)20-15/h3-5,7H,8,17H2,1-2H3,(H2,18,20).
What are the key properties of 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile?
8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile has a molecular weight of 280.34 g/mol, XLogP of 1.28, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-6-(5-amino-2-methylphenyl)-6-methyl-5H-imidazo[1,2-a]pyrazine-3-carbonitrile is sourced from PubChem (CID 163640888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).