6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one

C23H25FN2O4 — CID 3243761

IUPAC6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one
SMILESCOc1ccc(N2C(=O)CCC(C(=O)N3CCOCC3)C2c2ccc(F)cc2)cc1
InChIInChI=1S/C23H25FN2O4/c1-29-19-8-6-18(7-9-19)26-21(27)11-10-20(23(28)25-12-14-30-15-13-25)22(26)16-2-4-17(24)5-3-16/h2-9,20,22H,10-15H2,1H3
InChIKeyFXGKAQHXFGXOPR-UHFFFAOYSA-N
MW412.46 g/mol
LogP3.18
Rot. Bonds4

About 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one

6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one (PubChem CID 3243761) has the molecular formula C23H25FN2O4 and a molecular weight of 412.46 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one.

Molecular Properties

Compound Name6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one
PubChem CID3243761
Molecular FormulaC23H25FN2O4
Molecular Weight412.46 g/mol
Exact Mass412.18
IUPAC Name6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one
SMILESCOc1ccc(N2C(=O)CCC(C(=O)N3CCOCC3)C2c2ccc(F)cc2)cc1
InChIInChI=1S/C23H25FN2O4/c1-29-19-8-6-18(7-9-19)26-21(27)11-10-20(23(28)25-12-14-30-15-13-25)22(26)16-2-4-17(24)5-3-16/h2-9,20,22H,10-15H2,1H3
InChIKeyFXGKAQHXFGXOPR-UHFFFAOYSA-N
XLogP3.18
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.46
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one?
The IUPAC name of 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one (CID 3243761) is 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one.
What is the SMILES notation for 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one?
The canonical SMILES for 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one is COc1ccc(N2C(=O)CCC(C(=O)N3CCOCC3)C2c2ccc(F)cc2)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one?
The InChIKey is FXGKAQHXFGXOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN2O4/c1-29-19-8-6-18(7-9-19)26-21(27)11-10-20(23(28)25-12-14-30-15-13-25)22(26)16-2-4-17(24)5-3-16/h2-9,20,22H,10-15H2,1H3.
What are the key properties of 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one?
6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one has a molecular weight of 412.46 g/mol, XLogP of 3.18, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-1-(4-methoxyphenyl)-5-(morpholine-4-carbonyl)piperidin-2-one is sourced from PubChem (CID 3243761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).