7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine

C21H13FN6 — CID 152831094

IUPAC7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine
SMILESNc1nc(-c2ccc(F)cc2)c(-c2ccc3nccnc3c2)c2nccnc12
InChIInChI=1S/C21H13FN6/c22-14-4-1-12(2-5-14)18-17(19-20(21(23)28-18)27-10-9-26-19)13-3-6-15-16(11-13)25-8-7-24-15/h1-11H,(H2,23,28)
InChIKeySWFLYGYAERCZMO-UHFFFAOYSA-N
MW368.38 g/mol
LogP4.02
Rot. Bonds2

About 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine

7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine (PubChem CID 152831094) has the molecular formula C21H13FN6 and a molecular weight of 368.38 g/mol. Its IUPAC name is 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine.

Molecular Properties

Compound Name7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine
PubChem CID152831094
Molecular FormulaC21H13FN6
Molecular Weight368.38 g/mol
Exact Mass368.12
IUPAC Name7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine
SMILESNc1nc(-c2ccc(F)cc2)c(-c2ccc3nccnc3c2)c2nccnc12
InChIInChI=1S/C21H13FN6/c22-14-4-1-12(2-5-14)18-17(19-20(21(23)28-18)27-10-9-26-19)13-3-6-15-16(11-13)25-8-7-24-15/h1-11H,(H2,23,28)
InChIKeySWFLYGYAERCZMO-UHFFFAOYSA-N
XLogP4.02
TPSA90.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.38
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine?
The IUPAC name of 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine (CID 152831094) is 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine.
What is the SMILES notation for 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine?
The canonical SMILES for 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine is Nc1nc(-c2ccc(F)cc2)c(-c2ccc3nccnc3c2)c2nccnc12.
What is the InChIKey of 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine?
The InChIKey is SWFLYGYAERCZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13FN6/c22-14-4-1-12(2-5-14)18-17(19-20(21(23)28-18)27-10-9-26-19)13-3-6-15-16(11-13)25-8-7-24-15/h1-11H,(H2,23,28).
What are the key properties of 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine?
7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine has a molecular weight of 368.38 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-fluorophenyl)-8-quinoxalin-6-ylpyrido[3,4-b]pyrazin-5-amine is sourced from PubChem (CID 152831094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).