4-(5-bromo-6-chloropyrazin-2-yl)morpholine

C8H9BrClN3O — CID 75481752

IUPAC4-(5-bromo-6-chloropyrazin-2-yl)morpholine
SMILESClc1nc(N2CCOCC2)cnc1Br
InChIInChI=1S/C8H9BrClN3O/c9-7-8(10)12-6(5-11-7)13-1-3-14-4-2-13/h5H,1-4H2
InChIKeyQSSIJDROYUXWPZ-UHFFFAOYSA-N
MW278.54 g/mol
LogP1.73
Rot. Bonds1

About 4-(5-bromo-6-chloropyrazin-2-yl)morpholine

4-(5-bromo-6-chloropyrazin-2-yl)morpholine (PubChem CID 75481752) has the molecular formula C8H9BrClN3O and a molecular weight of 278.54 g/mol. Its IUPAC name is 4-(5-bromo-6-chloropyrazin-2-yl)morpholine.

Molecular Properties

Compound Name4-(5-bromo-6-chloropyrazin-2-yl)morpholine
PubChem CID75481752
Molecular FormulaC8H9BrClN3O
Molecular Weight278.54 g/mol
Exact Mass276.96
IUPAC Name4-(5-bromo-6-chloropyrazin-2-yl)morpholine
SMILESClc1nc(N2CCOCC2)cnc1Br
InChIInChI=1S/C8H9BrClN3O/c9-7-8(10)12-6(5-11-7)13-1-3-14-4-2-13/h5H,1-4H2
InChIKeyQSSIJDROYUXWPZ-UHFFFAOYSA-N
XLogP1.73
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.54
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(5-bromo-6-chloropyrazin-2-yl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(5-bromo-6-chloropyrazin-2-yl)morpholine?
The IUPAC name of 4-(5-bromo-6-chloropyrazin-2-yl)morpholine (CID 75481752) is 4-(5-bromo-6-chloropyrazin-2-yl)morpholine.
What is the SMILES notation for 4-(5-bromo-6-chloropyrazin-2-yl)morpholine?
The canonical SMILES for 4-(5-bromo-6-chloropyrazin-2-yl)morpholine is Clc1nc(N2CCOCC2)cnc1Br.
What is the InChIKey of 4-(5-bromo-6-chloropyrazin-2-yl)morpholine?
The InChIKey is QSSIJDROYUXWPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrClN3O/c9-7-8(10)12-6(5-11-7)13-1-3-14-4-2-13/h5H,1-4H2.
What are the key properties of 4-(5-bromo-6-chloropyrazin-2-yl)morpholine?
4-(5-bromo-6-chloropyrazin-2-yl)morpholine has a molecular weight of 278.54 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-bromo-6-chloropyrazin-2-yl)morpholine is sourced from PubChem (CID 75481752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).