4-[1-(4-bromophenoxy)ethyl]morpholine

C12H16BrNO2 — CID 18446587

IUPAC4-[1-(4-bromophenoxy)ethyl]morpholine
SMILESCC(Oc1ccc(Br)cc1)N1CCOCC1
InChIInChI=1S/C12H16BrNO2/c1-10(14-6-8-15-9-7-14)16-12-4-2-11(13)3-5-12/h2-5,10H,6-9H2,1H3
InChIKeyHPUOAVPMYWZFJT-UHFFFAOYSA-N
MW286.17 g/mol
LogP2.51
Rot. Bonds3

About 4-[1-(4-bromophenoxy)ethyl]morpholine

4-[1-(4-bromophenoxy)ethyl]morpholine (PubChem CID 18446587) has the molecular formula C12H16BrNO2 and a molecular weight of 286.17 g/mol. Its IUPAC name is 4-[1-(4-bromophenoxy)ethyl]morpholine.

Molecular Properties

Compound Name4-[1-(4-bromophenoxy)ethyl]morpholine
PubChem CID18446587
Molecular FormulaC12H16BrNO2
Molecular Weight286.17 g/mol
Exact Mass285.04
IUPAC Name4-[1-(4-bromophenoxy)ethyl]morpholine
SMILESCC(Oc1ccc(Br)cc1)N1CCOCC1
InChIInChI=1S/C12H16BrNO2/c1-10(14-6-8-15-9-7-14)16-12-4-2-11(13)3-5-12/h2-5,10H,6-9H2,1H3
InChIKeyHPUOAVPMYWZFJT-UHFFFAOYSA-N
XLogP2.51
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.17
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-(1-morpholin-4-ylethoxy)naphthalene-2-sulfonic acid
CID 89239885
1-(4-bromophenyl)-2-morpholin-4-ylpropan-1-amine
CID 91515805
4-[1-[7-(1-morpholin-4-ylethoxy)dibenzofuran-2-yl]oxyethyl]morpholine;dihydrochloride
CID 141034719
(2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide
CID 2203701
(2R)-2-(4-bromophenyl)-2-morpholin-4-ylacetonitrile
CID 703306
5-(1-morpholin-4-ylethoxy)-1-benzofuran-2-carbaldehyde
CID 57220321
1-bromo-4-(1-bromoethoxy)benzene
CID 68938279
2-(4-bromophenoxy)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 18153802
(2S)-1-(4-bromophenoxy)-3-morpholin-4-ylpropan-2-ol
CID 735568
N-[(4-bromophenyl)methyl]-2-morpholin-4-ylpropan-1-amine
CID 135042570
4-[(2S,5R)-5-(4-methylphenoxy)hexan-2-yl]morpholine
CID 1363274
2-(4-bromophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
CID 132666019

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-bromophenoxy)ethyl]morpholine?
The IUPAC name of 4-[1-(4-bromophenoxy)ethyl]morpholine (CID 18446587) is 4-[1-(4-bromophenoxy)ethyl]morpholine.
What is the SMILES notation for 4-[1-(4-bromophenoxy)ethyl]morpholine?
The canonical SMILES for 4-[1-(4-bromophenoxy)ethyl]morpholine is CC(Oc1ccc(Br)cc1)N1CCOCC1.
What is the InChIKey of 4-[1-(4-bromophenoxy)ethyl]morpholine?
The InChIKey is HPUOAVPMYWZFJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrNO2/c1-10(14-6-8-15-9-7-14)16-12-4-2-11(13)3-5-12/h2-5,10H,6-9H2,1H3.
What are the key properties of 4-[1-(4-bromophenoxy)ethyl]morpholine?
4-[1-(4-bromophenoxy)ethyl]morpholine has a molecular weight of 286.17 g/mol, XLogP of 2.51, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-bromophenoxy)ethyl]morpholine is sourced from PubChem (CID 18446587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).