2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one

C18H18N4O3 — CID 22263554

IUPAC2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(C2CNCCO2)nc2cc(OCc3cccnc3)ccn12
InChIInChI=1S/C18H18N4O3/c23-18-9-15(16-11-20-5-7-24-16)21-17-8-14(3-6-22(17)18)25-12-13-2-1-4-19-10-13/h1-4,6,8-10,16,20H,5,7,11-12H2
InChIKeyKLNGIEMIYQRXEX-UHFFFAOYSA-N
MW338.37 g/mol
LogP1.33
Rot. Bonds4

About 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one

2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 22263554) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one
PubChem CID22263554
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC Name2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(C2CNCCO2)nc2cc(OCc3cccnc3)ccn12
InChIInChI=1S/C18H18N4O3/c23-18-9-15(16-11-20-5-7-24-16)21-17-8-14(3-6-22(17)18)25-12-13-2-1-4-19-10-13/h1-4,6,8-10,16,20H,5,7,11-12H2
InChIKeyKLNGIEMIYQRXEX-UHFFFAOYSA-N
XLogP1.33
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-morpholin-2-yl-8-phenoxypyrido[1,2-a]pyrimidin-4-one
CID 22263564
3-[3-(pyridin-3-ylmethoxy)phenyl]-5-[(3S)-pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 120840442
2-[[4-[[4-(2-pyridin-3-ylethynyl)phenoxy]methyl]phenyl]methyl]morpholine
CID 174937811
8-methoxy-2-pyrrolidin-3-ylpyrido[1,2-a]pyrimidin-4-one
CID 115054719
3-[[4-(pyridin-3-ylmethoxy)phenoxy]methyl]pyridine
CID 91147542
2-(3-pyridin-3-ylimidazol-4-yl)morpholine
CID 114717439
(2S)-2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)morpholine;hydrochloride
CID 120836949
(2S)-2-[3-[(3-fluorophenoxy)methyl]-1,2,4-oxadiazol-5-yl]morpholine;hydrochloride
CID 120893635
1-[2-[4-(hydroxymethyl)phenyl]ethyl]-4-(pyridin-3-ylmethoxy)pyridin-2-one
CID 67007472
2-pyridin-2-ylmorpholine
CID 19353403
4-piperazin-1-yl-7-(pyridin-3-ylmethoxy)chromen-2-one
CID 16735942
(2S)-2-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]morpholine;hydrochloride
CID 120836385

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one (CID 22263554) is 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one is O=c1cc(C2CNCCO2)nc2cc(OCc3cccnc3)ccn12.
What is the InChIKey of 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is KLNGIEMIYQRXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c23-18-9-15(16-11-20-5-7-24-16)21-17-8-14(3-6-22(17)18)25-12-13-2-1-4-19-10-13/h1-4,6,8-10,16,20H,5,7,11-12H2.
What are the key properties of 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one?
2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 338.37 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-2-yl-8-(pyridin-3-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 22263554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).