4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine

C20H20ClFN2O2 — CID 10595604

IUPAC4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine
SMILESFc1ccc(-n2cc(OCCN3CCOCC3)c3cc(Cl)ccc32)cc1
InChIInChI=1S/C20H20ClFN2O2/c21-15-1-6-19-18(13-15)20(26-12-9-23-7-10-25-11-8-23)14-24(19)17-4-2-16(22)3-5-17/h1-6,13-14H,7-12H2
InChIKeySXQIOPRIKSIRIW-UHFFFAOYSA-N
MW374.84 g/mol
LogP4.13
Rot. Bonds5

About 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine

4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine (PubChem CID 10595604) has the molecular formula C20H20ClFN2O2 and a molecular weight of 374.84 g/mol. Its IUPAC name is 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine
PubChem CID10595604
Molecular FormulaC20H20ClFN2O2
Molecular Weight374.84 g/mol
Exact Mass374.12
IUPAC Name4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine
SMILESFc1ccc(-n2cc(OCCN3CCOCC3)c3cc(Cl)ccc32)cc1
InChIInChI=1S/C20H20ClFN2O2/c21-15-1-6-19-18(13-15)20(26-12-9-23-7-10-25-11-8-23)14-24(19)17-4-2-16(22)3-5-17/h1-6,13-14H,7-12H2
InChIKeySXQIOPRIKSIRIW-UHFFFAOYSA-N
XLogP4.13
TPSA26.63 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.84
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine?
The IUPAC name of 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine (CID 10595604) is 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine.
What is the SMILES notation for 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine?
The canonical SMILES for 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine is Fc1ccc(-n2cc(OCCN3CCOCC3)c3cc(Cl)ccc32)cc1.
What is the InChIKey of 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine?
The InChIKey is SXQIOPRIKSIRIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClFN2O2/c21-15-1-6-19-18(13-15)20(26-12-9-23-7-10-25-11-8-23)14-24(19)17-4-2-16(22)3-5-17/h1-6,13-14H,7-12H2.
What are the key properties of 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine?
4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine has a molecular weight of 374.84 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[5-chloro-1-(4-fluorophenyl)indol-3-yl]oxyethyl]morpholine is sourced from PubChem (CID 10595604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).