5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one

C19H21FN2O5 — CID 16853824

IUPAC5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one
SMILESO=C(Cn1cc(OCc2ccc(F)cc2)c(=O)cc1CO)N1CCOCC1
InChIInChI=1S/C19H21FN2O5/c20-15-3-1-14(2-4-15)13-27-18-10-22(16(12-23)9-17(18)24)11-19(25)21-5-7-26-8-6-21/h1-4,9-10,23H,5-8,11-13H2
InChIKeyHNRGQOACCVOCQO-UHFFFAOYSA-N
MW376.38 g/mol
LogP0.92
Rot. Bonds6

About 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one

5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one (PubChem CID 16853824) has the molecular formula C19H21FN2O5 and a molecular weight of 376.38 g/mol. Its IUPAC name is 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one.

Molecular Properties

Compound Name5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one
PubChem CID16853824
Molecular FormulaC19H21FN2O5
Molecular Weight376.38 g/mol
Exact Mass376.14
IUPAC Name5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one
SMILESO=C(Cn1cc(OCc2ccc(F)cc2)c(=O)cc1CO)N1CCOCC1
InChIInChI=1S/C19H21FN2O5/c20-15-3-1-14(2-4-15)13-27-18-10-22(16(12-23)9-17(18)24)11-19(25)21-5-7-26-8-6-21/h1-4,9-10,23H,5-8,11-13H2
InChIKeyHNRGQOACCVOCQO-UHFFFAOYSA-N
XLogP0.92
TPSA81.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.38
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one?
The IUPAC name of 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one (CID 16853824) is 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one.
What is the SMILES notation for 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one?
The canonical SMILES for 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one is O=C(Cn1cc(OCc2ccc(F)cc2)c(=O)cc1CO)N1CCOCC1.
What is the InChIKey of 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one?
The InChIKey is HNRGQOACCVOCQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O5/c20-15-3-1-14(2-4-15)13-27-18-10-22(16(12-23)9-17(18)24)11-19(25)21-5-7-26-8-6-21/h1-4,9-10,23H,5-8,11-13H2.
What are the key properties of 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one?
5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one has a molecular weight of 376.38 g/mol, XLogP of 0.92, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluorophenyl)methoxy]-2-(hydroxymethyl)-1-(2-morpholin-4-yl-2-oxoethyl)pyridin-4-one is sourced from PubChem (CID 16853824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).