6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile

C7H2Br2N4 — CID 14207626

IUPAC6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile
SMILESN#Cc1cn2cc(Br)nc(Br)c2n1
InChIInChI=1S/C7H2Br2N4/c8-5-3-13-2-4(1-10)11-7(13)6(9)12-5/h2-3H
InChIKeyJWIKNKJBSJAYRY-UHFFFAOYSA-N
MW301.93 g/mol
LogP2.13
Rot. Bonds

About 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile

6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile (PubChem CID 14207626) has the molecular formula C7H2Br2N4 and a molecular weight of 301.93 g/mol. Its IUPAC name is 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile
PubChem CID14207626
Molecular FormulaC7H2Br2N4
Molecular Weight301.93 g/mol
Exact Mass299.86
IUPAC Name6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile
SMILESN#Cc1cn2cc(Br)nc(Br)c2n1
InChIInChI=1S/C7H2Br2N4/c8-5-3-13-2-4(1-10)11-7(13)6(9)12-5/h2-3H
InChIKeyJWIKNKJBSJAYRY-UHFFFAOYSA-N
XLogP2.13
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.93
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile?
The IUPAC name of 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile (CID 14207626) is 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile.
What is the SMILES notation for 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile?
The canonical SMILES for 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile is N#Cc1cn2cc(Br)nc(Br)c2n1.
What is the InChIKey of 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile?
The InChIKey is JWIKNKJBSJAYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2Br2N4/c8-5-3-13-2-4(1-10)11-7(13)6(9)12-5/h2-3H.
What are the key properties of 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile?
6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile has a molecular weight of 301.93 g/mol, XLogP of 2.13, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dibromoimidazo[1,2-a]pyrazine-2-carbonitrile is sourced from PubChem (CID 14207626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).