2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one

C19H21FN2O4 — CID 148853210

IUPAC2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one
SMILESCOc1cc(CC(=O)CC2=NC(N3CCOCC3)=CC(=O)C2)ccc1F
InChIInChI=1S/C19H21FN2O4/c1-25-18-9-13(2-3-17(18)20)8-15(23)10-14-11-16(24)12-19(21-14)22-4-6-26-7-5-22/h2-3,9,12H,4-8,10-11H2,1H3
InChIKeyOXWAOSAXXWAYSJ-UHFFFAOYSA-N
MW360.39 g/mol
LogP1.92
Rot. Bonds6

About 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one

2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one (PubChem CID 148853210) has the molecular formula C19H21FN2O4 and a molecular weight of 360.39 g/mol. Its IUPAC name is 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one.

Molecular Properties

Compound Name2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one
PubChem CID148853210
Molecular FormulaC19H21FN2O4
Molecular Weight360.39 g/mol
Exact Mass360.15
IUPAC Name2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one
SMILESCOc1cc(CC(=O)CC2=NC(N3CCOCC3)=CC(=O)C2)ccc1F
InChIInChI=1S/C19H21FN2O4/c1-25-18-9-13(2-3-17(18)20)8-15(23)10-14-11-16(24)12-19(21-14)22-4-6-26-7-5-22/h2-3,9,12H,4-8,10-11H2,1H3
InChIKeyOXWAOSAXXWAYSJ-UHFFFAOYSA-N
XLogP1.92
TPSA68.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[3-(3,5-difluorophenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 158411819
2-[3-(2,3-difluorophenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 160582302
2-(6-morpholin-4-yl-4-oxo-3H-pyridin-2-yl)-N-(2,4,5-trifluorophenyl)acetamide
CID 148949691
2-[3-(1-benzofuran-4-yl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 161402750
2-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 160884209
2-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-3H-pyridin-4-one;2-[2-[(2S)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 160884208
2-[2-(4,6-difluoro-2,3-dihydroindol-1-yl)-2-oxoethyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 158474103
4-[(4-fluoro-3-methoxyphenyl)methyl]morpholine
CID 71190630
2-[(5-methyl-3H-indol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 147637522
2-(3-methoxy-4-methylphenyl)-1-morpholin-4-ylethanone
CID 60700942
2-(3,4-difluorophenyl)-N-(2,6-dimethyl-4-morpholin-4-ylphenyl)acetamide
CID 11574057
1-(3,4-dichlorophenyl)-3-(3-fluoro-4-methoxyphenyl)propan-2-one
CID 62622130

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one?
The IUPAC name of 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one (CID 148853210) is 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one.
What is the SMILES notation for 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one?
The canonical SMILES for 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one is COc1cc(CC(=O)CC2=NC(N3CCOCC3)=CC(=O)C2)ccc1F.
What is the InChIKey of 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one?
The InChIKey is OXWAOSAXXWAYSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O4/c1-25-18-9-13(2-3-17(18)20)8-15(23)10-14-11-16(24)12-19(21-14)22-4-6-26-7-5-22/h2-3,9,12H,4-8,10-11H2,1H3.
What are the key properties of 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one?
2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one has a molecular weight of 360.39 g/mol, XLogP of 1.92, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-fluoro-3-methoxyphenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one is sourced from PubChem (CID 148853210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).