4-(3-bromo-5-ethylphenyl)morpholine

C12H16BrNO — CID 155289670

IUPAC4-(3-bromo-5-ethylphenyl)morpholine
SMILESCCc1cc(Br)cc(N2CCOCC2)c1
InChIInChI=1S/C12H16BrNO/c1-2-10-7-11(13)9-12(8-10)14-3-5-15-6-4-14/h7-9H,2-6H2,1H3
InChIKeyTUHZPBNVDNJESP-UHFFFAOYSA-N
MW270.17 g/mol
LogP2.85
Rot. Bonds2

About 4-(3-bromo-5-ethylphenyl)morpholine

4-(3-bromo-5-ethylphenyl)morpholine (PubChem CID 155289670) has the molecular formula C12H16BrNO and a molecular weight of 270.17 g/mol. Its IUPAC name is 4-(3-bromo-5-ethylphenyl)morpholine.

Molecular Properties

Compound Name4-(3-bromo-5-ethylphenyl)morpholine
PubChem CID155289670
Molecular FormulaC12H16BrNO
Molecular Weight270.17 g/mol
Exact Mass269.04
IUPAC Name4-(3-bromo-5-ethylphenyl)morpholine
SMILESCCc1cc(Br)cc(N2CCOCC2)c1
InChIInChI=1S/C12H16BrNO/c1-2-10-7-11(13)9-12(8-10)14-3-5-15-6-4-14/h7-9H,2-6H2,1H3
InChIKeyTUHZPBNVDNJESP-UHFFFAOYSA-N
XLogP2.85
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-ethylphenyl)morpholine
CID 20576442
4-(5-ethyl-3-pyridinyl)morpholine
CID 130219562
3-bromo-N-methyl-5-morpholin-4-ylbenzenesulfonamide
CID 163230978
13-(3,5-dimethylphenyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 10519968
2-ethyl-6-methyl-4-morpholin-4-ylaniline
CID 83707293
4-(4-ethyl-3-methylphenyl)morpholine
CID 71052308
4-[3-bromo-5-(oxolan-3-ylsulfanyl)phenyl]morpholine
CID 146173826
5-morpholin-4-ylbenzene-1,3-diol
CID 58923367
1-(3-amino-5-morpholin-4-ylphenyl)propan-2-one
CID 59631041
4-[(3-bromo-5-fluorophenyl)methyl]morpholine
CID 79673314
[3-bromo-5-(2,2,6,6-tetramethylmorpholin-4-yl)phenyl]methanamine
CID 102814387
1-(3-morpholin-4-ylphenyl)propan-2-amine
CID 117314833

Frequently Asked Questions

What is the IUPAC name of 4-(3-bromo-5-ethylphenyl)morpholine?
The IUPAC name of 4-(3-bromo-5-ethylphenyl)morpholine (CID 155289670) is 4-(3-bromo-5-ethylphenyl)morpholine.
What is the SMILES notation for 4-(3-bromo-5-ethylphenyl)morpholine?
The canonical SMILES for 4-(3-bromo-5-ethylphenyl)morpholine is CCc1cc(Br)cc(N2CCOCC2)c1.
What is the InChIKey of 4-(3-bromo-5-ethylphenyl)morpholine?
The InChIKey is TUHZPBNVDNJESP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrNO/c1-2-10-7-11(13)9-12(8-10)14-3-5-15-6-4-14/h7-9H,2-6H2,1H3.
What are the key properties of 4-(3-bromo-5-ethylphenyl)morpholine?
4-(3-bromo-5-ethylphenyl)morpholine has a molecular weight of 270.17 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bromo-5-ethylphenyl)morpholine is sourced from PubChem (CID 155289670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).