5-imidazo[4,5-b]pyrazin-3-ylquinoline

C14H9N5 — CID 67318104

IUPAC5-imidazo[4,5-b]pyrazin-3-ylquinoline
SMILESc1cc(-n2cnc3nccnc32)c2cccnc2c1
InChIInChI=1S/C14H9N5/c1-4-11-10(3-2-6-15-11)12(5-1)19-9-18-13-14(19)17-8-7-16-13/h1-9H
InChIKeyKNPFUHUGURADMQ-UHFFFAOYSA-N
MW247.26 g/mol
LogP2.36
Rot. Bonds1

About 5-imidazo[4,5-b]pyrazin-3-ylquinoline

5-imidazo[4,5-b]pyrazin-3-ylquinoline (PubChem CID 67318104) has the molecular formula C14H9N5 and a molecular weight of 247.26 g/mol. Its IUPAC name is 5-imidazo[4,5-b]pyrazin-3-ylquinoline.

Molecular Properties

Compound Name5-imidazo[4,5-b]pyrazin-3-ylquinoline
PubChem CID67318104
Molecular FormulaC14H9N5
Molecular Weight247.26 g/mol
Exact Mass247.09
IUPAC Name5-imidazo[4,5-b]pyrazin-3-ylquinoline
SMILESc1cc(-n2cnc3nccnc32)c2cccnc2c1
InChIInChI=1S/C14H9N5/c1-4-11-10(3-2-6-15-11)12(5-1)19-9-18-13-14(19)17-8-7-16-13/h1-9H
InChIKeyKNPFUHUGURADMQ-UHFFFAOYSA-N
XLogP2.36
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-imidazo[4,5-b]pyrazin-3-ylquinoline?
The IUPAC name of 5-imidazo[4,5-b]pyrazin-3-ylquinoline (CID 67318104) is 5-imidazo[4,5-b]pyrazin-3-ylquinoline.
What is the SMILES notation for 5-imidazo[4,5-b]pyrazin-3-ylquinoline?
The canonical SMILES for 5-imidazo[4,5-b]pyrazin-3-ylquinoline is c1cc(-n2cnc3nccnc32)c2cccnc2c1.
What is the InChIKey of 5-imidazo[4,5-b]pyrazin-3-ylquinoline?
The InChIKey is KNPFUHUGURADMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N5/c1-4-11-10(3-2-6-15-11)12(5-1)19-9-18-13-14(19)17-8-7-16-13/h1-9H.
What are the key properties of 5-imidazo[4,5-b]pyrazin-3-ylquinoline?
5-imidazo[4,5-b]pyrazin-3-ylquinoline has a molecular weight of 247.26 g/mol, XLogP of 2.36, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-imidazo[4,5-b]pyrazin-3-ylquinoline is sourced from PubChem (CID 67318104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).