5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine

C12H9BrN4 — CID 87086919

IUPAC5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine
SMILESBrc1cnc(Nc2ccccc2)c2nccn12
InChIInChI=1S/C12H9BrN4/c13-10-8-15-11(12-14-6-7-17(10)12)16-9-4-2-1-3-5-9/h1-8H,(H,15,16)
InChIKeyMFFPCDPCVFWEFQ-UHFFFAOYSA-N
MW289.14 g/mol
LogP3.24
Rot. Bonds2

About 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine

5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 87086919) has the molecular formula C12H9BrN4 and a molecular weight of 289.14 g/mol. Its IUPAC name is 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine
PubChem CID87086919
Molecular FormulaC12H9BrN4
Molecular Weight289.14 g/mol
Exact Mass288.00
IUPAC Name5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine
SMILESBrc1cnc(Nc2ccccc2)c2nccn12
InChIInChI=1S/C12H9BrN4/c13-10-8-15-11(12-14-6-7-17(10)12)16-9-4-2-1-3-5-9/h1-8H,(H,15,16)
InChIKeyMFFPCDPCVFWEFQ-UHFFFAOYSA-N
XLogP3.24
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.14
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine (CID 87086919) is 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine is Brc1cnc(Nc2ccccc2)c2nccn12.
What is the InChIKey of 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is MFFPCDPCVFWEFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrN4/c13-10-8-15-11(12-14-6-7-17(10)12)16-9-4-2-1-3-5-9/h1-8H,(H,15,16).
What are the key properties of 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine?
5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 289.14 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-phenylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 87086919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).