6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline

C22H16N4 — CID 155549987

IUPAC6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
SMILESCc1ccccc1-c1cn2c(-c3ccc4ncccc4c3)cnc2cn1
InChIInChI=1S/C22H16N4/c1-15-5-2-3-7-18(15)20-14-26-21(12-25-22(26)13-24-20)17-8-9-19-16(11-17)6-4-10-23-19/h2-14H,1H3
InChIKeySXPUHPMTYKWABK-UHFFFAOYSA-N
MW336.40 g/mol
LogP4.92
Rot. Bonds2

About 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline

6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline (PubChem CID 155549987) has the molecular formula C22H16N4 and a molecular weight of 336.40 g/mol. Its IUPAC name is 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline.

Molecular Properties

Compound Name6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
PubChem CID155549987
Molecular FormulaC22H16N4
Molecular Weight336.40 g/mol
Exact Mass336.14
IUPAC Name6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
SMILESCc1ccccc1-c1cn2c(-c3ccc4ncccc4c3)cnc2cn1
InChIInChI=1S/C22H16N4/c1-15-5-2-3-7-18(15)20-14-26-21(12-25-22(26)13-24-20)17-8-9-19-16(11-17)6-4-10-23-19/h2-14H,1H3
InChIKeySXPUHPMTYKWABK-UHFFFAOYSA-N
XLogP4.92
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The IUPAC name of 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline (CID 155549987) is 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline.
What is the SMILES notation for 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The canonical SMILES for 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline is Cc1ccccc1-c1cn2c(-c3ccc4ncccc4c3)cnc2cn1.
What is the InChIKey of 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The InChIKey is SXPUHPMTYKWABK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4/c1-15-5-2-3-7-18(15)20-14-26-21(12-25-22(26)13-24-20)17-8-9-19-16(11-17)6-4-10-23-19/h2-14H,1H3.
What are the key properties of 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline has a molecular weight of 336.40 g/mol, XLogP of 4.92, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline is sourced from PubChem (CID 155549987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).