4-[2-(3,4-dichlorophenoxy)ethyl]morpholine

C12H15Cl2NO2 — CID 803039

IUPAC4-[2-(3,4-dichlorophenoxy)ethyl]morpholine
SMILESClc1ccc(OCCN2CCOCC2)cc1Cl
InChIInChI=1S/C12H15Cl2NO2/c13-11-2-1-10(9-12(11)14)17-8-5-15-3-6-16-7-4-15/h1-2,9H,3-8H2
InChIKeyYGNYZZBGVHICRQ-UHFFFAOYSA-N
MW276.16 g/mol
LogP2.70
Rot. Bonds4

About 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine

4-[2-(3,4-dichlorophenoxy)ethyl]morpholine (PubChem CID 803039) has the molecular formula C12H15Cl2NO2 and a molecular weight of 276.16 g/mol. Its IUPAC name is 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(3,4-dichlorophenoxy)ethyl]morpholine
PubChem CID803039
Molecular FormulaC12H15Cl2NO2
Molecular Weight276.16 g/mol
Exact Mass275.05
IUPAC Name4-[2-(3,4-dichlorophenoxy)ethyl]morpholine
SMILESClc1ccc(OCCN2CCOCC2)cc1Cl
InChIInChI=1S/C12H15Cl2NO2/c13-11-2-1-10(9-12(11)14)17-8-5-15-3-6-16-7-4-15/h1-2,9H,3-8H2
InChIKeyYGNYZZBGVHICRQ-UHFFFAOYSA-N
XLogP2.70
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.16
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Morpholine-4-carboxylic acid 3-chloro-phenyl ester
CID 735622
4-[2-(4-Chlorophenoxy)ethyl]morpholine
CID 868407
1-(2-(4-Chlorophenoxy)ethyl)piperazine
CID 894310
1-[(2S)-1-(4-chlorophenoxy)propan-2-yl]-4-methylpiperidine;hydrochloride
CID 10335163
1-[2-(4-Chlorophenoxy)ethyl]-4-methylpiperidine;hydrochloride
CID 45260623
4-(4-Chlorophenyloxycarbonyl)morpholine
CID 812959
1-[4-(3-Chlorophenoxy)butyl]piperidine
CID 2057691
1,4-Bis[2-(3-chlorophenoxy)ethyl]piperazine
CID 620153
N-[2-(3,5-dichlorophenoxy)ethyl]-N,N-dimethylamine
CID 3744277
1-[2-(3-Chloro-phenoxy)-ethyl]-pyrrolidine
CID 19661865
4-[2-(2,5-Dichlorophenoxy)ethyl]morpholine
CID 869248
1-[6-(3-Chlorophenoxy)hexyl]piperidine
CID 2057716

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine?
The IUPAC name of 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine (CID 803039) is 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine.
What is the SMILES notation for 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine?
The canonical SMILES for 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine is Clc1ccc(OCCN2CCOCC2)cc1Cl.
What is the InChIKey of 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine?
The InChIKey is YGNYZZBGVHICRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Cl2NO2/c13-11-2-1-10(9-12(11)14)17-8-5-15-3-6-16-7-4-15/h1-2,9H,3-8H2.
What are the key properties of 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine?
4-[2-(3,4-dichlorophenoxy)ethyl]morpholine has a molecular weight of 276.16 g/mol, XLogP of 2.70, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3,4-dichlorophenoxy)ethyl]morpholine is sourced from PubChem (CID 803039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).