4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine

C19H18FN3O2 — CID 67034968

IUPAC4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine
SMILESCOc1cc(F)cc(-c2ccc3ncc(N4CCOCC4)nc3c2)c1
InChIInChI=1S/C19H18FN3O2/c1-24-16-9-14(8-15(20)11-16)13-2-3-17-18(10-13)22-19(12-21-17)23-4-6-25-7-5-23/h2-3,8-12H,4-7H2,1H3
InChIKeyZVKDBTDRLJSQAP-UHFFFAOYSA-N
MW339.37 g/mol
LogP3.28
Rot. Bonds3

About 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine

4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine (PubChem CID 67034968) has the molecular formula C19H18FN3O2 and a molecular weight of 339.37 g/mol. Its IUPAC name is 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine.

Molecular Properties

Compound Name4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine
PubChem CID67034968
Molecular FormulaC19H18FN3O2
Molecular Weight339.37 g/mol
Exact Mass339.14
IUPAC Name4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine
SMILESCOc1cc(F)cc(-c2ccc3ncc(N4CCOCC4)nc3c2)c1
InChIInChI=1S/C19H18FN3O2/c1-24-16-9-14(8-15(20)11-16)13-2-3-17-18(10-13)22-19(12-21-17)23-4-6-25-7-5-23/h2-3,8-12H,4-7H2,1H3
InChIKeyZVKDBTDRLJSQAP-UHFFFAOYSA-N
XLogP3.28
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine?
The IUPAC name of 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine (CID 67034968) is 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine.
What is the SMILES notation for 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine?
The canonical SMILES for 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine is COc1cc(F)cc(-c2ccc3ncc(N4CCOCC4)nc3c2)c1.
What is the InChIKey of 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine?
The InChIKey is ZVKDBTDRLJSQAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O2/c1-24-16-9-14(8-15(20)11-16)13-2-3-17-18(10-13)22-19(12-21-17)23-4-6-25-7-5-23/h2-3,8-12H,4-7H2,1H3.
What are the key properties of 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine?
4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine has a molecular weight of 339.37 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-(3-fluoro-5-methoxyphenyl)quinoxalin-2-yl]morpholine is sourced from PubChem (CID 67034968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).