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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Related Compounds

4-[(3-Cyano-benzyl)-(3-methyl-3H-imidazol-4-ylmethyl)-amino]-2-naphthalen-1-YL-benzonitrile
CID 447390
5-[(3-Cyano-benzyl)-(3-methyl-3H-imidazol-4-ylmethyl)-amino]-2''-methyl-biphenyl-2-carbonitrile
CID 44278126
4-[4-(3-isopropyl-2-methyl-3H-imidazol-4-yl)pyrimidin-2-ylamino]-benzonitrile
CID 44578536
4-(2-(3,4-Dimethylphenylamino)ethyl)-1H-imidazole
CID 46222044
3-Methyl-8-[4-((methylsufonyl)amino)phenyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 13810560
4-(4-(2-aminopropan-2-yl)phenyl)-2-(4-(2-(2-ethyl-1H-imidazol-1-yl)ethyl)phenylamino)pyrimidine-5-carbonitrile
CID 18516938
2-Cyano(3-(5-methyl-1H-imidazol-1-yl)propyl)-3-(3,4-dimethylphenyl)guanidine
CID 25054968
2-Cyano-1-[3-(5-methyl-1H-imidazol-1-yl)propyl]-4-phenylbenzene-1-guanidine
CID 25054970
5-[Benzyl-(3H-imidazol-4-ylmethyl)-amino]-2''-methyl-biphenyl-2-carbonitrile
CID 44278053
5-[Benzyl-(3-methyl-3H-imidazol-4-ylmethyl)-amino]-2''-methyl-biphenyl-2-carbonitrile
CID 44278125
5-[(4-Cyano-benzyl)-(3-methyl-3H-imidazol-4-ylmethyl)-amino]-2''-methyl-biphenyl-2-carbonitrile
CID 44278127
4-[Benzyl-[(3-methylimidazol-4-yl)methyl]amino]-2-naphthalen-1-ylbenzonitrile
CID 44278183

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).