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

C23H18N4O — CID 155554084

IUPAC6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
SMILESCCOc1cccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)c1
InChIInChI=1S/C23H18N4O/c1-2-28-19-7-3-5-17(12-19)21-15-27-22(13-26-23(27)14-25-21)18-8-9-20-16(11-18)6-4-10-24-20/h3-15H,2H2,1H3
InChIKeyUUKBEQDSDPAHBD-UHFFFAOYSA-N
MW366.42 g/mol
LogP5.01
Rot. Bonds4

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

6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline (PubChem CID 155554084) has the molecular formula C23H18N4O and a molecular weight of 366.42 g/mol. Its IUPAC name is 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline.

Molecular Properties

Compound Name6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
PubChem CID155554084
Molecular FormulaC23H18N4O
Molecular Weight366.42 g/mol
Exact Mass366.15
IUPAC Name6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
SMILESCCOc1cccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)c1
InChIInChI=1S/C23H18N4O/c1-2-28-19-7-3-5-17(12-19)21-15-27-22(13-26-23(27)14-25-21)18-8-9-20-16(11-18)6-4-10-24-20/h3-15H,2H2,1H3
InChIKeyUUKBEQDSDPAHBD-UHFFFAOYSA-N
XLogP5.01
TPSA52.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.42
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The IUPAC name of 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline (CID 155554084) is 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline.
What is the SMILES notation for 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The canonical SMILES for 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline is CCOc1cccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)c1.
What is the InChIKey of 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The InChIKey is UUKBEQDSDPAHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O/c1-2-28-19-7-3-5-17(12-19)21-15-27-22(13-26-23(27)14-25-21)18-8-9-20-16(11-18)6-4-10-24-20/h3-15H,2H2,1H3.
What are the key properties of 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline has a molecular weight of 366.42 g/mol, XLogP of 5.01, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(3-ethoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline is sourced from PubChem (CID 155554084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).