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

C13H15N3O2 — CID 23586740

IUPAC9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cccn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C13H15N3O2/c1-10-3-2-4-16-12(17)9-11(14-13(10)16)15-5-7-18-8-6-15/h2-4,9H,5-8H2,1H3
InChIKeyLXZHACFXMVRMMH-UHFFFAOYSA-N
MW245.28 g/mol
LogP0.84
Rot. Bonds1

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

9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 23586740) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
PubChem CID23586740
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cccn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C13H15N3O2/c1-10-3-2-4-16-12(17)9-11(14-13(10)16)15-5-7-18-8-6-15/h2-4,9H,5-8H2,1H3
InChIKeyLXZHACFXMVRMMH-UHFFFAOYSA-N
XLogP0.84
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (CID 23586740) is 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is Cc1cccn2c(=O)cc(N3CCOCC3)nc12.
What is the InChIKey of 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is LXZHACFXMVRMMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-10-3-2-4-16-12(17)9-11(14-13(10)16)15-5-7-18-8-6-15/h2-4,9H,5-8H2,1H3.
What are the key properties of 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 245.28 g/mol, XLogP of 0.84, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 23586740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).