4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine

C20H23ClFNO2 — CID 170870408

IUPAC4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine
SMILESFc1ccc(COc2ccc(Cl)cc2CCCN2CCOCC2)cc1
InChIInChI=1S/C20H23ClFNO2/c21-18-5-8-20(25-15-16-3-6-19(22)7-4-16)17(14-18)2-1-9-23-10-12-24-13-11-23/h3-8,14H,1-2,9-13,15H2
InChIKeyMDLANZFDACYIKT-UHFFFAOYSA-N
MW363.86 g/mol
LogP4.32
Rot. Bonds7

About 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine

4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine (PubChem CID 170870408) has the molecular formula C20H23ClFNO2 and a molecular weight of 363.86 g/mol. Its IUPAC name is 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine.

Molecular Properties

Compound Name4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine
PubChem CID170870408
Molecular FormulaC20H23ClFNO2
Molecular Weight363.86 g/mol
Exact Mass363.14
IUPAC Name4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine
SMILESFc1ccc(COc2ccc(Cl)cc2CCCN2CCOCC2)cc1
InChIInChI=1S/C20H23ClFNO2/c21-18-5-8-20(25-15-16-3-6-19(22)7-4-16)17(14-18)2-1-9-23-10-12-24-13-11-23/h3-8,14H,1-2,9-13,15H2
InChIKeyMDLANZFDACYIKT-UHFFFAOYSA-N
XLogP4.32
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.86
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-[5-chloro-2-[(2-chlorophenyl)methoxy]phenyl]propyl]morpholine
CID 170870417
4-[3-[2-[(3-chlorophenyl)methoxy]phenyl]propyl]morpholine
CID 170870365
4-[3-(2-phenylmethoxyphenyl)propyl]morpholine
CID 170869183
4-[3-[2,5-bis(phenylmethoxy)phenyl]propyl]morpholine
CID 170870322
4-[3-[5-bromo-2-[(2-fluorophenyl)methoxy]phenyl]propyl]morpholine
CID 170870233
N-[[2-[(4-fluorophenyl)methoxy]phenyl]methyl]-3-morpholin-4-ylpropan-1-amine;dihydrochloride
CID 17289404
4-[2-(5-chloro-2-ethoxyphenyl)ethyl]morpholine;methanamine
CID 177027735
4-[3-[4-[(2,4-dichlorophenyl)methoxy]-3-ethoxyphenyl]propyl]morpholine
CID 170870173
4-[3-[2-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]propyl]morpholine
CID 170870445
4-[3-[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]propyl]morpholine
CID 170870151
4-[3-[2-(3-morpholin-4-ylpropoxy)phenyl]propyl]morpholine
CID 170869645
3-fluoro-4-(3-morpholin-4-ylpropyl)phenol
CID 170869738

Frequently Asked Questions

What is the IUPAC name of 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine?
The IUPAC name of 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine (CID 170870408) is 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine.
What is the SMILES notation for 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine?
The canonical SMILES for 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine is Fc1ccc(COc2ccc(Cl)cc2CCCN2CCOCC2)cc1.
What is the InChIKey of 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine?
The InChIKey is MDLANZFDACYIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClFNO2/c21-18-5-8-20(25-15-16-3-6-19(22)7-4-16)17(14-18)2-1-9-23-10-12-24-13-11-23/h3-8,14H,1-2,9-13,15H2.
What are the key properties of 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine?
4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine has a molecular weight of 363.86 g/mol, XLogP of 4.32, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]propyl]morpholine is sourced from PubChem (CID 170870408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).