4-[2-(2-bromophenyl)propyl]morpholine

C13H18BrNO — CID 115052168

IUPAC4-[2-(2-bromophenyl)propyl]morpholine
SMILESCC(CN1CCOCC1)c1ccccc1Br
InChIInChI=1S/C13H18BrNO/c1-11(10-15-6-8-16-9-7-15)12-4-2-3-5-13(12)14/h2-5,11H,6-10H2,1H3
InChIKeyRKDSUDDFWOSVBO-UHFFFAOYSA-N
MW284.20 g/mol
LogP2.88
Rot. Bonds3

About 4-[2-(2-bromophenyl)propyl]morpholine

4-[2-(2-bromophenyl)propyl]morpholine (PubChem CID 115052168) has the molecular formula C13H18BrNO and a molecular weight of 284.20 g/mol. Its IUPAC name is 4-[2-(2-bromophenyl)propyl]morpholine.

Molecular Properties

Compound Name4-[2-(2-bromophenyl)propyl]morpholine
PubChem CID115052168
Molecular FormulaC13H18BrNO
Molecular Weight284.20 g/mol
Exact Mass283.06
IUPAC Name4-[2-(2-bromophenyl)propyl]morpholine
SMILESCC(CN1CCOCC1)c1ccccc1Br
InChIInChI=1S/C13H18BrNO/c1-11(10-15-6-8-16-9-7-15)12-4-2-3-5-13(12)14/h2-5,11H,6-10H2,1H3
InChIKeyRKDSUDDFWOSVBO-UHFFFAOYSA-N
XLogP2.88
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.20
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-Phenylbutyl)morpholine
CID 2845822
(S)-3-(3-Bromo-phenyl)-1-propyl-piperidine
CID 10356389
4-[2-[(3E)-3-[(2-bromophenyl)methylidene]inden-1-yl]ethyl]morpholine
CID 118332423
4-(2-Phenylpropyl)morpholine
CID 2845855
2-(4-Bromo-phenyl)-1-morpholin-4-YL-ethanethione
CID 582517
4-(3-Bromobenzyl)morpholine
CID 783082
4-(4-Bromobenzyl)morpholine
CID 783503
4-(2-Bromobenzyl)morpholine
CID 2845477
Morpholine, 4-(beta-bromophenethyl)-, hydrobromide
CID 3022064
Piperidinium, 1-(4-(o-bromophenyl)-2-butenyl)-1-(carboxymethyl)-, chloride, butyl ester
CID 6445938
4-(4-Bromophenethyl)morpholine
CID 12177801
4-[3-(3-Bromophenyl)propyl]morpholine
CID 46739426

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-bromophenyl)propyl]morpholine?
The IUPAC name of 4-[2-(2-bromophenyl)propyl]morpholine (CID 115052168) is 4-[2-(2-bromophenyl)propyl]morpholine.
What is the SMILES notation for 4-[2-(2-bromophenyl)propyl]morpholine?
The canonical SMILES for 4-[2-(2-bromophenyl)propyl]morpholine is CC(CN1CCOCC1)c1ccccc1Br.
What is the InChIKey of 4-[2-(2-bromophenyl)propyl]morpholine?
The InChIKey is RKDSUDDFWOSVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18BrNO/c1-11(10-15-6-8-16-9-7-15)12-4-2-3-5-13(12)14/h2-5,11H,6-10H2,1H3.
What are the key properties of 4-[2-(2-bromophenyl)propyl]morpholine?
4-[2-(2-bromophenyl)propyl]morpholine has a molecular weight of 284.20 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-bromophenyl)propyl]morpholine is sourced from PubChem (CID 115052168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).