9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one

C20H21N3O3 — CID 23586726

IUPAC9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1ccc(COc2cccn3c(=O)cc(N4CCOCC4)nc23)cc1
InChIInChI=1S/C20H21N3O3/c1-15-4-6-16(7-5-15)14-26-17-3-2-8-23-19(24)13-18(21-20(17)23)22-9-11-25-12-10-22/h2-8,13H,9-12,14H2,1H3
InChIKeySQQXTDNHUWWPJR-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.42
Rot. Bonds4

About 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one

9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 23586726) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
PubChem CID23586726
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1ccc(COc2cccn3c(=O)cc(N4CCOCC4)nc23)cc1
InChIInChI=1S/C20H21N3O3/c1-15-4-6-16(7-5-15)14-26-17-3-2-8-23-19(24)13-18(21-20(17)23)22-9-11-25-12-10-22/h2-8,13H,9-12,14H2,1H3
InChIKeySQQXTDNHUWWPJR-UHFFFAOYSA-N
XLogP2.42
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-morpholin-4-yl-9-(pyridin-4-ylmethoxy)pyrido[1,2-a]pyrimidin-4-one
CID 23586755
N-(4-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide
CID 122179714
4-[2,4-dimethyl-5-[(4-methylphenyl)methoxy]quinazolin-7-yl]morpholine
CID 158577556
9-ethenyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 164600757
9-methyl-2-(4-oxa-7-azaspiro[2.5]octan-7-yl)pyrido[1,2-a]pyrimidin-4-one
CID 166291945
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
1-[(4-chlorophenyl)methyl]-7-morpholin-4-ylimidazo[1,2-a]pyrimidin-5-one
CID 57398390
9-(2,6-dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 122179708
9-(1-bromoethyl)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 164600769
9-[(1S)-1-anilinoethyl]-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 51601994
2-[4-(2-chlorophenyl)piperazin-1-yl]-9-methylpyrido[1,2-a]pyrimidin-4-one
CID 141363668

Frequently Asked Questions

What is the IUPAC name of 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (CID 23586726) is 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is Cc1ccc(COc2cccn3c(=O)cc(N4CCOCC4)nc23)cc1.
What is the InChIKey of 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is SQQXTDNHUWWPJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-15-4-6-16(7-5-15)14-26-17-3-2-8-23-19(24)13-18(21-20(17)23)22-9-11-25-12-10-22/h2-8,13H,9-12,14H2,1H3.
What are the key properties of 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 351.41 g/mol, XLogP of 2.42, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(4-methylphenyl)methoxy]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 23586726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).