8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine

C13H11BrFN5 — CID 107639344

IUPAC8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCNc1cn2ccnc2c(Nc2cc(F)ccc2Br)n1
InChIInChI=1S/C13H11BrFN5/c1-16-11-7-20-5-4-17-13(20)12(19-11)18-10-6-8(15)2-3-9(10)14/h2-7,16H,1H3,(H,18,19)
InChIKeyBVQYQJLPLFGJHS-UHFFFAOYSA-N
MW336.17 g/mol
LogP3.42
Rot. Bonds3

About 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine

8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 107639344) has the molecular formula C13H11BrFN5 and a molecular weight of 336.17 g/mol. Its IUPAC name is 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID107639344
Molecular FormulaC13H11BrFN5
Molecular Weight336.17 g/mol
Exact Mass335.02
IUPAC Name8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCNc1cn2ccnc2c(Nc2cc(F)ccc2Br)n1
InChIInChI=1S/C13H11BrFN5/c1-16-11-7-20-5-4-17-13(20)12(19-11)18-10-6-8(15)2-3-9(10)14/h2-7,16H,1H3,(H,18,19)
InChIKeyBVQYQJLPLFGJHS-UHFFFAOYSA-N
XLogP3.42
TPSA54.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.17
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

8-N-(4-fluoro-2-methylphenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80762083
8-N-(2-bromophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80761144
8-N-(2-bromo-4-fluorophenyl)-6-N-ethylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80749003
N-(2,5-dibromophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80896841
8-N-(2-fluoro-5-methoxyphenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80839755
8-N-(4-bromo-3-methoxyphenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 82860804
8-N-(2-bromo-4-fluorophenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80754857
6-bromo-N-(4-fluoro-2-methylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 79955945
5-fluoro-2-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]benzonitrile
CID 82682483
6-N-methyl-8-N-(3-methylphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80754749
8-N-(1,3-dimethylpyrazol-4-yl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 102807864
N-(4-bromo-2,3-dichlorophenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 107795439

Frequently Asked Questions

What is the IUPAC name of 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine (CID 107639344) is 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine is CNc1cn2ccnc2c(Nc2cc(F)ccc2Br)n1.
What is the InChIKey of 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is BVQYQJLPLFGJHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrFN5/c1-16-11-7-20-5-4-17-13(20)12(19-11)18-10-6-8(15)2-3-9(10)14/h2-7,16H,1H3,(H,18,19).
What are the key properties of 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 336.17 g/mol, XLogP of 3.42, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(2-bromo-5-fluorophenyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 107639344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).