4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine

C20H24ClNO2 — CID 58923289

IUPAC4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine
SMILESCC(c1ccc(Cl)cc1)c1ccc(OCCN2CCOCC2)cc1
InChIInChI=1S/C20H24ClNO2/c1-16(17-2-6-19(21)7-3-17)18-4-8-20(9-5-18)24-15-12-22-10-13-23-14-11-22/h2-9,16H,10-15H2,1H3
InChIKeyXNQPBQZDMHMZHE-UHFFFAOYSA-N
MW345.87 g/mol
LogP4.20
Rot. Bonds6

About 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine

4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine (PubChem CID 58923289) has the molecular formula C20H24ClNO2 and a molecular weight of 345.87 g/mol. Its IUPAC name is 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine
PubChem CID58923289
Molecular FormulaC20H24ClNO2
Molecular Weight345.87 g/mol
Exact Mass345.15
IUPAC Name4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine
SMILESCC(c1ccc(Cl)cc1)c1ccc(OCCN2CCOCC2)cc1
InChIInChI=1S/C20H24ClNO2/c1-16(17-2-6-19(21)7-3-17)18-4-8-20(9-5-18)24-15-12-22-10-13-23-14-11-22/h2-9,16H,10-15H2,1H3
InChIKeyXNQPBQZDMHMZHE-UHFFFAOYSA-N
XLogP4.20
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.87
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 43503698
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342
4-[3-[4-[(2S)-butan-2-yl]phenoxy]propyl]morpholine
CID 2299717
N-ethyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]propan-1-amine
CID 60888208
4-[2-[4-(4-phenylbut-3-yn-2-yl)phenoxy]ethyl]morpholine
CID 118384322
(4-chlorophenyl)-[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
CID 23553296
4-(2-morpholin-4-ylethoxy)aniline;hydrochloride
CID 89422137
CID 161147503
CID 161147503
4-[2-(3-methyl-4-propan-2-ylphenoxy)ethyl]morpholine
CID 3386987
4-[2-(4-ethynylphenoxy)ethyl]morpholine
CID 58608139
(1R)-1-[5-chloro-2-(2-morpholin-4-ylethoxy)phenyl]ethanamine
CID 55189907
4-[2-(4-methylphenoxy)ethyl]morpholine;oxalic acid
CID 44827969

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine?
The IUPAC name of 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine (CID 58923289) is 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine is CC(c1ccc(Cl)cc1)c1ccc(OCCN2CCOCC2)cc1.
What is the InChIKey of 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine?
The InChIKey is XNQPBQZDMHMZHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClNO2/c1-16(17-2-6-19(21)7-3-17)18-4-8-20(9-5-18)24-15-12-22-10-13-23-14-11-22/h2-9,16H,10-15H2,1H3.
What are the key properties of 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine?
4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine has a molecular weight of 345.87 g/mol, XLogP of 4.20, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-[1-(4-chlorophenyl)ethyl]phenoxy]ethyl]morpholine is sourced from PubChem (CID 58923289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).