6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine

C14H18BrN3O — CID 79955751

IUPAC6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine
SMILESCCC1CCCCC1Oc1nc(Br)cn2ccnc12
InChIInChI=1S/C14H18BrN3O/c1-2-10-5-3-4-6-11(10)19-14-13-16-7-8-18(13)9-12(15)17-14/h7-11H,2-6H2,1H3
InChIKeyAUFRHCCOBKEYBN-UHFFFAOYSA-N
MW324.22 g/mol
LogP3.84
Rot. Bonds3

About 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine

6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine (PubChem CID 79955751) has the molecular formula C14H18BrN3O and a molecular weight of 324.22 g/mol. Its IUPAC name is 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine
PubChem CID79955751
Molecular FormulaC14H18BrN3O
Molecular Weight324.22 g/mol
Exact Mass323.06
IUPAC Name6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine
SMILESCCC1CCCCC1Oc1nc(Br)cn2ccnc12
InChIInChI=1S/C14H18BrN3O/c1-2-10-5-3-4-6-11(10)19-14-13-16-7-8-18(13)9-12(15)17-14/h7-11H,2-6H2,1H3
InChIKeyAUFRHCCOBKEYBN-UHFFFAOYSA-N
XLogP3.84
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.22
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine?
The IUPAC name of 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine (CID 79955751) is 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine?
The canonical SMILES for 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine is CCC1CCCCC1Oc1nc(Br)cn2ccnc12.
What is the InChIKey of 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine?
The InChIKey is AUFRHCCOBKEYBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrN3O/c1-2-10-5-3-4-6-11(10)19-14-13-16-7-8-18(13)9-12(15)17-14/h7-11H,2-6H2,1H3.
What are the key properties of 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine?
6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine has a molecular weight of 324.22 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-(2-ethylcyclohexyl)oxyimidazo[1,2-a]pyrazine is sourced from PubChem (CID 79955751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).