2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one

C18H18N4O3 — CID 23586755

IUPAC2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(N2CCOCC2)nc2c(OCc3ccncc3)cccn12
InChIInChI=1S/C18H18N4O3/c23-17-12-16(21-8-10-24-11-9-21)20-18-15(2-1-7-22(17)18)25-13-14-3-5-19-6-4-14/h1-7,12H,8-11,13H2
InChIKeySJNFXLCCVYCSTE-UHFFFAOYSA-N
MW338.37 g/mol
LogP1.51
Rot. Bonds4

About 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one

2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 23586755) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one
PubChem CID23586755
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC Name2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(N2CCOCC2)nc2c(OCc3ccncc3)cccn12
InChIInChI=1S/C18H18N4O3/c23-17-12-16(21-8-10-24-11-9-21)20-18-15(2-1-7-22(17)18)25-13-14-3-5-19-6-4-14/h1-7,12H,8-11,13H2
InChIKeySJNFXLCCVYCSTE-UHFFFAOYSA-N
XLogP1.51
TPSA68.96 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 23586726
1-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)-3-phenylurea
CID 122179723
8-[(3-chlorophenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 69035466
N-(4-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide
CID 122179714
9-methyl-2-(4-oxa-7-azaspiro[2.5]octan-7-yl)pyrido[1,2-a]pyrimidin-4-one
CID 166291945
7-methyl-2-morpholin-4-yl-9-(2-pyridin-4-ylethenyl)pyrido[1,2-a]pyrimidin-4-one
CID 74066587
1-[(4-chlorophenyl)methyl]-7-morpholin-4-ylimidazo[1,2-a]pyrimidin-5-one
CID 57398390
3-[4-morpholin-4-yl-6-(pyridin-4-ylmethoxy)-1,3,5-triazin-2-yl]phenol
CID 58508309
9-ethenyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 164600757
2-[4-(2-chlorophenyl)piperazin-1-yl]-9-methylpyrido[1,2-a]pyrimidin-4-one
CID 141363668
9-(2,6-dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 122179708
4-methyl-6-morpholin-4-yl-N-(pyridin-4-ylmethyl)pyrimidin-2-amine
CID 112912080

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one (CID 23586755) is 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one is O=c1cc(N2CCOCC2)nc2c(OCc3ccncc3)cccn12.
What is the InChIKey of 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is SJNFXLCCVYCSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c23-17-12-16(21-8-10-24-11-9-21)20-18-15(2-1-7-22(17)18)25-13-14-3-5-19-6-4-14/h1-7,12H,8-11,13H2.
What are the key properties of 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one?
2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 338.37 g/mol, XLogP of 1.51, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 23586755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).