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

C21H13FN4 — CID 155562527

IUPAC6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
SMILESFc1cccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)c1
InChIInChI=1S/C21H13FN4/c22-17-5-1-3-15(10-17)19-13-26-20(11-25-21(26)12-24-19)16-6-7-18-14(9-16)4-2-8-23-18/h1-13H
InChIKeyDIGYETNLHIQYQL-UHFFFAOYSA-N
MW340.36 g/mol
LogP4.75
Rot. Bonds2

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

6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline (PubChem CID 155562527) has the molecular formula C21H13FN4 and a molecular weight of 340.36 g/mol. Its IUPAC name is 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline.

Molecular Properties

Compound Name6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
PubChem CID155562527
Molecular FormulaC21H13FN4
Molecular Weight340.36 g/mol
Exact Mass340.11
IUPAC Name6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline
SMILESFc1cccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)c1
InChIInChI=1S/C21H13FN4/c22-17-5-1-3-15(10-17)19-13-26-20(11-25-21(26)12-24-19)16-6-7-18-14(9-16)4-2-8-23-18/h1-13H
InChIKeyDIGYETNLHIQYQL-UHFFFAOYSA-N
XLogP4.75
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.36
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The IUPAC name of 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline (CID 155562527) is 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline.
What is the SMILES notation for 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The canonical SMILES for 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline is Fc1cccc(-c2cn3c(-c4ccc5ncccc5c4)cnc3cn2)c1.
What is the InChIKey of 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
The InChIKey is DIGYETNLHIQYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13FN4/c22-17-5-1-3-15(10-17)19-13-26-20(11-25-21(26)12-24-19)16-6-7-18-14(9-16)4-2-8-23-18/h1-13H.
What are the key properties of 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline?
6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline has a molecular weight of 340.36 g/mol, XLogP of 4.75, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]quinoline is sourced from PubChem (CID 155562527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).