4-[2-(4-bromophenoxy)ethyl]morpholine

C12H16BrNO2 — CID 2053815

IUPAC4-[2-(4-bromophenoxy)ethyl]morpholine
SMILESBrc1ccc(OCCN2CCOCC2)cc1
InChIInChI=1S/C12H16BrNO2/c13-11-1-3-12(4-2-11)16-10-7-14-5-8-15-9-6-14/h1-4H,5-10H2
InChIKeySWXZUUKQIQPHIC-UHFFFAOYSA-N
MW286.17 g/mol
LogP2.16
Rot. Bonds4

About 4-[2-(4-bromophenoxy)ethyl]morpholine

4-[2-(4-bromophenoxy)ethyl]morpholine (PubChem CID 2053815) has the molecular formula C12H16BrNO2 and a molecular weight of 286.17 g/mol. Its IUPAC name is 4-[2-(4-bromophenoxy)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(4-bromophenoxy)ethyl]morpholine
PubChem CID2053815
Molecular FormulaC12H16BrNO2
Molecular Weight286.17 g/mol
Exact Mass285.04
IUPAC Name4-[2-(4-bromophenoxy)ethyl]morpholine
SMILESBrc1ccc(OCCN2CCOCC2)cc1
InChIInChI=1S/C12H16BrNO2/c13-11-1-3-12(4-2-11)16-10-7-14-5-8-15-9-6-14/h1-4H,5-10H2
InChIKeySWXZUUKQIQPHIC-UHFFFAOYSA-N
XLogP2.16
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.17
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[2-(4-bromophenoxy)ethyl]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-[2-(4-bromophenoxy)ethyl]morpholine?
The IUPAC name of 4-[2-(4-bromophenoxy)ethyl]morpholine (CID 2053815) is 4-[2-(4-bromophenoxy)ethyl]morpholine.
What is the SMILES notation for 4-[2-(4-bromophenoxy)ethyl]morpholine?
The canonical SMILES for 4-[2-(4-bromophenoxy)ethyl]morpholine is Brc1ccc(OCCN2CCOCC2)cc1.
What is the InChIKey of 4-[2-(4-bromophenoxy)ethyl]morpholine?
The InChIKey is SWXZUUKQIQPHIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrNO2/c13-11-1-3-12(4-2-11)16-10-7-14-5-8-15-9-6-14/h1-4H,5-10H2.
What are the key properties of 4-[2-(4-bromophenoxy)ethyl]morpholine?
4-[2-(4-bromophenoxy)ethyl]morpholine has a molecular weight of 286.17 g/mol, XLogP of 2.16, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-bromophenoxy)ethyl]morpholine is sourced from PubChem (CID 2053815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).