9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one

C15H17N3O3 — CID 53487956

IUPAC9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCC(=O)c1cc(C)cn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C15H17N3O3/c1-10-7-12(11(2)19)15-16-13(8-14(20)18(15)9-10)17-3-5-21-6-4-17/h7-9H,3-6H2,1-2H3
InChIKeyLEYQJUBFWATMMS-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.04
Rot. Bonds2

About 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one

9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 53487956) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
PubChem CID53487956
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCC(=O)c1cc(C)cn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C15H17N3O3/c1-10-7-12(11(2)19)15-16-13(8-14(20)18(15)9-10)17-3-5-21-6-4-17/h7-9H,3-6H2,1-2H3
InChIKeyLEYQJUBFWATMMS-UHFFFAOYSA-N
XLogP1.04
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (CID 53487956) is 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is CC(=O)c1cc(C)cn2c(=O)cc(N3CCOCC3)nc12.
What is the InChIKey of 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is LEYQJUBFWATMMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10-7-12(11(2)19)15-16-13(8-14(20)18(15)9-10)17-3-5-21-6-4-17/h7-9H,3-6H2,1-2H3.
What are the key properties of 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 287.32 g/mol, XLogP of 1.04, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-acetyl-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 53487956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).