3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine

C19H16BrN5 — CID 10318453

IUPAC3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESBrc1cnc2c(NCCc3ccncc3)nc(-c3ccccc3)cn12
InChIInChI=1S/C19H16BrN5/c20-17-12-23-19-18(22-11-8-14-6-9-21-10-7-14)24-16(13-25(17)19)15-4-2-1-3-5-15/h1-7,9-10,12-13H,8,11H2,(H,22,24)
InChIKeyABYYVFLVUXOVIH-UHFFFAOYSA-N
MW394.28 g/mol
LogP4.21
Rot. Bonds5

About 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine

3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 10318453) has the molecular formula C19H16BrN5 and a molecular weight of 394.28 g/mol. Its IUPAC name is 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID10318453
Molecular FormulaC19H16BrN5
Molecular Weight394.28 g/mol
Exact Mass393.06
IUPAC Name3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESBrc1cnc2c(NCCc3ccncc3)nc(-c3ccccc3)cn12
InChIInChI=1S/C19H16BrN5/c20-17-12-23-19-18(22-11-8-14-6-9-21-10-7-14)24-16(13-25(17)19)15-4-2-1-3-5-15/h1-7,9-10,12-13H,8,11H2,(H,22,24)
InChIKeyABYYVFLVUXOVIH-UHFFFAOYSA-N
XLogP4.21
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.28
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine (CID 10318453) is 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine is Brc1cnc2c(NCCc3ccncc3)nc(-c3ccccc3)cn12.
What is the InChIKey of 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is ABYYVFLVUXOVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16BrN5/c20-17-12-23-19-18(22-11-8-14-6-9-21-10-7-14)24-16(13-25(17)19)15-4-2-1-3-5-15/h1-7,9-10,12-13H,8,11H2,(H,22,24).
What are the key properties of 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine?
3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 394.28 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 10318453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).