4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine

C19H20ClF2NO2 — CID 42867771

IUPAC4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine
SMILESFc1ccc(C(CCN2CCOCC2)Oc2ccc(F)cc2Cl)cc1
InChIInChI=1S/C19H20ClF2NO2/c20-17-13-16(22)5-6-19(17)25-18(14-1-3-15(21)4-2-14)7-8-23-9-11-24-12-10-23/h1-6,13,18H,7-12H2
InChIKeyJEHZWOYCMGZMSP-UHFFFAOYSA-N
MW367.82 g/mol
LogP4.46
Rot. Bonds6

About 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine

4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine (PubChem CID 42867771) has the molecular formula C19H20ClF2NO2 and a molecular weight of 367.82 g/mol. Its IUPAC name is 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine.

Molecular Properties

Compound Name4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine
PubChem CID42867771
Molecular FormulaC19H20ClF2NO2
Molecular Weight367.82 g/mol
Exact Mass367.12
IUPAC Name4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine
SMILESFc1ccc(C(CCN2CCOCC2)Oc2ccc(F)cc2Cl)cc1
InChIInChI=1S/C19H20ClF2NO2/c20-17-13-16(22)5-6-19(17)25-18(14-1-3-15(21)4-2-14)7-8-23-9-11-24-12-10-23/h1-6,13,18H,7-12H2
InChIKeyJEHZWOYCMGZMSP-UHFFFAOYSA-N
XLogP4.46
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.82
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-(4-chlorophenyl)-3-(4-fluoro-2-methylphenoxy)propyl]morpholine
CID 42867876
1-benzyl-4-[3-(2-chloro-4-fluorophenoxy)-3-(4-chlorophenyl)propyl]piperazine
CID 42867881
4-[3-(4-fluorophenyl)-3-quinolin-8-yloxypropyl]morpholine
CID 42867773
4-[3-(2-fluoro-5-methylphenoxy)-3-(4-methoxyphenyl)propyl]morpholine
CID 42867792
1-[3-(1,3-benzodioxol-5-yl)-3-(2-chlorophenoxy)propyl]-4-(4-fluorophenyl)piperazine
CID 42867963
2-(2-chloro-4-fluorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 35161239
1-(4-fluorophenyl)-4-morpholin-4-ylbutan-1-ol
CID 4132449
4-[3-(4-fluoro-3-methylphenoxy)-3-(4-methoxyphenyl)propyl]morpholine
CID 42869879
4-[2-[4-[6-(2-chloro-4-fluorophenoxy)pyrimidin-4-yl]piperazin-1-yl]ethyl]morpholine
CID 83289253
2-(2-chloro-4-fluorophenoxy)-1-morpholin-4-ylethanone
CID 17190853
1-benzyl-4-[3-(2-chlorophenyl)-3-(2,4-difluorophenoxy)propyl]piperazine
CID 42867725
4-[3-phenyl-3-[3-(trifluoromethyl)phenoxy]propyl]morpholine
CID 42867737

Frequently Asked Questions

What is the IUPAC name of 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine?
The IUPAC name of 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine (CID 42867771) is 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine.
What is the SMILES notation for 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine?
The canonical SMILES for 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine is Fc1ccc(C(CCN2CCOCC2)Oc2ccc(F)cc2Cl)cc1.
What is the InChIKey of 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine?
The InChIKey is JEHZWOYCMGZMSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClF2NO2/c20-17-13-16(22)5-6-19(17)25-18(14-1-3-15(21)4-2-14)7-8-23-9-11-24-12-10-23/h1-6,13,18H,7-12H2.
What are the key properties of 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine?
4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine has a molecular weight of 367.82 g/mol, XLogP of 4.46, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2-chloro-4-fluorophenoxy)-3-(4-fluorophenyl)propyl]morpholine is sourced from PubChem (CID 42867771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).