2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine

C9H12BrN5 — CID 84712577

IUPAC2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine
SMILESCNc1nc(Br)cn2cc(CCN)nc12
InChIInChI=1S/C9H12BrN5/c1-12-8-9-13-6(2-3-11)4-15(9)5-7(10)14-8/h4-5H,2-3,11H2,1H3,(H,12,14)
InChIKeyFTEFEXBUVUEXEY-UHFFFAOYSA-N
MW270.13 g/mol
LogP1.03
Rot. Bonds3

About 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine

2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 84712577) has the molecular formula C9H12BrN5 and a molecular weight of 270.13 g/mol. Its IUPAC name is 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine
PubChem CID84712577
Molecular FormulaC9H12BrN5
Molecular Weight270.13 g/mol
Exact Mass269.03
IUPAC Name2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine
SMILESCNc1nc(Br)cn2cc(CCN)nc12
InChIInChI=1S/C9H12BrN5/c1-12-8-9-13-6(2-3-11)4-15(9)5-7(10)14-8/h4-5H,2-3,11H2,1H3,(H,12,14)
InChIKeyFTEFEXBUVUEXEY-UHFFFAOYSA-N
XLogP1.03
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.13
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine (CID 84712577) is 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine is CNc1nc(Br)cn2cc(CCN)nc12.
What is the InChIKey of 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is FTEFEXBUVUEXEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12BrN5/c1-12-8-9-13-6(2-3-11)4-15(9)5-7(10)14-8/h4-5H,2-3,11H2,1H3,(H,12,14).
What are the key properties of 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine?
2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 270.13 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-6-bromo-N-methylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 84712577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).