6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine

C12H8BrFN4 — CID 79955944

IUPAC6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESFc1cccc(Nc2nc(Br)cn3ccnc23)c1
InChIInChI=1S/C12H8BrFN4/c13-10-7-18-5-4-15-12(18)11(17-10)16-9-3-1-2-8(14)6-9/h1-7H,(H,16,17)
InChIKeyVKVOKRACHHIXDO-UHFFFAOYSA-N
MW307.13 g/mol
LogP3.37
Rot. Bonds2

About 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine

6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 79955944) has the molecular formula C12H8BrFN4 and a molecular weight of 307.13 g/mol. Its IUPAC name is 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID79955944
Molecular FormulaC12H8BrFN4
Molecular Weight307.13 g/mol
Exact Mass305.99
IUPAC Name6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESFc1cccc(Nc2nc(Br)cn3ccnc23)c1
InChIInChI=1S/C12H8BrFN4/c13-10-7-18-5-4-15-12(18)11(17-10)16-9-3-1-2-8(14)6-9/h1-7H,(H,16,17)
InChIKeyVKVOKRACHHIXDO-UHFFFAOYSA-N
XLogP3.37
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.13
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine (CID 79955944) is 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine is Fc1cccc(Nc2nc(Br)cn3ccnc23)c1.
What is the InChIKey of 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is VKVOKRACHHIXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrFN4/c13-10-7-18-5-4-15-12(18)11(17-10)16-9-3-1-2-8(14)6-9/h1-7H,(H,16,17).
What are the key properties of 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine?
6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 307.13 g/mol, XLogP of 3.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(3-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 79955944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).